77350-52-8,MFCD02217872
Catalog No.:AA005NMG

77350-52-8 | N,N-Diethyl-4-iodobenzamide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$33.00   $23.00
- +
250mg
98%
in stock  
$51.00   $36.00
- +
1g
98%
in stock  
$139.00   $97.00
- +
5g
98%
in stock  
$363.00   $254.00
- +
10g
98%
in stock  
$678.00   $475.00
- +
25g
98%
in stock  
$1,345.00 $942.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA005NMG
Chemical Name:
N,N-Diethyl-4-iodobenzamide
CAS Number:
77350-52-8
Molecular Formula:
C11H14INO
Molecular Weight:
303.1394
MDL Number:
MFCD02217872
SMILES:
CCN(C(=O)c1ccc(cc1)I)CC
Properties
Properties
 
Form:
Solid  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
184  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.9  

Downstream Synthesis Route

[1]Amatore,Christian;Jutand,Anny;Negri,Serge;Fauvarque,Jean-Francois[JournalofOrganometallicChemistry,1990,vol.390,#3,p.389-398]

[1]Amatore,Christian;Jutand,Anny;Negri,Serge;Fauvarque,Jean-Francois[JournalofOrganometallicChemistry,1990,vol.390,#3,p.389-398]

[1]Wolfe,JohnP.;Buchwald,StephenL.[JournalofOrganicChemistry,1996,vol.61,#3,p.1133-1135]

[2]Gryf-Keller,Adam;Terpinski,Jacek;Zajaczkowska-Terpinska,Ewa[PolishJournalofChemistry,1980,vol.54,#7/8,p.1465-1471]

[3]CurrentPatentAssignee:ASTRAZENECAPLC-WO2004/41801,2004,A1Locationinpatent:Page36-37

[4]CurrentPatentAssignee:ASTRAZENECAPLC-US5691349,1997,A

[5]CurrentPatentAssignee:EqtPartnersAB;Galderma(in:EQTPartners)-US5716624,1998,A

[6]CurrentPatentAssignee:ASTRAZENECAPLC-WO2006/91160,2006,A1Locationinpatent:Page/Pagecolumn13;24

[7]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US4990505,1991,A

[8]Wallinder,Charlotta;Botros,Milad;Rosenström,Ulrika;Guimond,Marie-Odile;Beaudry,Hélène;Nyberg,Fred;Gallo-Payet,Nicole;Hallberg,Anders;Alterman,Mathias[BioorganicandMedicinalChemistry,2008,vol.16,#14,p.6841-6849]

[9]CurrentPatentAssignee:ASTRAZENECAPLC-WO2004/41800,2004,A1Locationinpatent:Page30

[10]CurrentPatentAssignee:ASTRAZENECAPLC-WO2004/41802,2004,A1Locationinpatent:Page35

[11]CurrentPatentAssignee:ASTRAZENECAPLC-WO2005/66148,2005,A1Locationinpatent:Page/Pagecolumn33

[12]CurrentPatentAssignee:ASTRAZENECAPLC;BROWNWILLAM-US2006/30569,2006,A1Locationinpatent:Page/Pagecolumn14

[13]CurrentPatentAssignee:ASTRAZENECAPLC-WO2011/65905,2011,A1Locationinpatent:Page/Pagecolumn55-56

[14]Sargent,BrendonT.;Alexanian,ErikJ.[JournaloftheAmericanChemicalSociety,2016,vol.138,#24,p.7520-7523]

111-26-2    77350-52-8   
N,N-Diethyl-4-hexylamino-benzamide 

[1]Wolfe,JohnP.;Buchwald,StephenL.[JournalofOrganicChemistry,1997,vol.62,#17,p.6066-6068]

[2]Wolfe,JohnP.;Buchwald,StephenL.[JournalofOrganicChemistry,1996,vol.61,#3,p.1133-1135]

77350-52-8    162883-19-4   
4-((3R,5R,8R,9S,10S,13S,14S,17S)-17-Acetyl-3-hydroxy-10,13-dimethyl-hexadecahydro-cyclopentaaphenanthren-3-ylethynyl)-N,N-diethyl-benzamide 

[1]Upasani,RavindraB.;Yang,KevinC.;Acosta-Burruel,Manuel;Konkoy,ChrisS.;McLellan,JamesA.;Woodward,RichardM.;Lan,NancyC.;Carter,RichardB.;Hawkinson,JonE.[JournalofMedicinalChemistry,1997,vol.40,#1,p.73-84]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Quotation Request
Company Name:
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Additional Info:
SDS
Tags:77350-52-8 Molecular Formula|77350-52-8 MDL|77350-52-8 SMILES|77350-52-8 N,N-Diethyl-4-iodobenzamide
Catalog No.: AA005NMG
77350-52-8,MFCD02217872
77350-52-8 | N,N-Diethyl-4-iodobenzamide
Pack Size: 100mg
Purity: 98%
in stock
$33.00 $23.00
Pack Size: 250mg
Purity: 98%
in stock
$51.00 $36.00
Pack Size: 1g
Purity: 98%
in stock
$139.00 $97.00
Pack Size: 5g
Purity: 98%
in stock
$363.00 $254.00
Pack Size: 10g
Purity: 98%
in stock
$678.00 $475.00
Pack Size: 25g
Purity: 98%
in stock
$1,345.00 $942.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA005NMG
Chemical Name: N,N-Diethyl-4-iodobenzamide
CAS Number: 77350-52-8
Molecular Formula: C11H14INO
Molecular Weight: 303.1394
MDL Number: MFCD02217872
SMILES: CCN(C(=O)c1ccc(cc1)I)CC
Properties
Form: Solid  
Storage: 2-8℃;  
Complexity: 184  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.9  
Downstream Synthesis Route
81745-86-0    77350-52-8    130447-19-7 

[1]Amatore,Christian;Jutand,Anny;Negri,Serge;Fauvarque,Jean-Francois[JournalofOrganometallicChemistry,1990,vol.390,#3,p.389-398]

77350-52-8    5713-61-1    130447-17-5 

[1]Amatore,Christian;Jutand,Anny;Negri,Serge;Fauvarque,Jean-Francois[JournalofOrganometallicChemistry,1990,vol.390,#3,p.389-398]

109-89-7    1711-02-0    77350-52-8 

[1]Wolfe,JohnP.;Buchwald,StephenL.[JournalofOrganicChemistry,1996,vol.61,#3,p.1133-1135]

[2]Gryf-Keller,Adam;Terpinski,Jacek;Zajaczkowska-Terpinska,Ewa[PolishJournalofChemistry,1980,vol.54,#7/8,p.1465-1471]

[3]CurrentPatentAssignee:ASTRAZENECAPLC-WO2004/41801,2004,A1Locationinpatent:Page36-37

[4]CurrentPatentAssignee:ASTRAZENECAPLC-US5691349,1997,A

[5]CurrentPatentAssignee:EqtPartnersAB;Galderma(in:EQTPartners)-US5716624,1998,A

[6]CurrentPatentAssignee:ASTRAZENECAPLC-WO2006/91160,2006,A1Locationinpatent:Page/Pagecolumn13;24

[7]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US4990505,1991,A

[8]Wallinder,Charlotta;Botros,Milad;Rosenström,Ulrika;Guimond,Marie-Odile;Beaudry,Hélène;Nyberg,Fred;Gallo-Payet,Nicole;Hallberg,Anders;Alterman,Mathias[BioorganicandMedicinalChemistry,2008,vol.16,#14,p.6841-6849]

[9]CurrentPatentAssignee:ASTRAZENECAPLC-WO2004/41800,2004,A1Locationinpatent:Page30

[10]CurrentPatentAssignee:ASTRAZENECAPLC-WO2004/41802,2004,A1Locationinpatent:Page35

[11]CurrentPatentAssignee:ASTRAZENECAPLC-WO2005/66148,2005,A1Locationinpatent:Page/Pagecolumn33

[12]CurrentPatentAssignee:ASTRAZENECAPLC;BROWNWILLAM-US2006/30569,2006,A1Locationinpatent:Page/Pagecolumn14

[13]CurrentPatentAssignee:ASTRAZENECAPLC-WO2011/65905,2011,A1Locationinpatent:Page/Pagecolumn55-56

[14]Sargent,BrendonT.;Alexanian,ErikJ.[JournaloftheAmericanChemicalSociety,2016,vol.138,#24,p.7520-7523]

111-26-2    77350-52-8   
N,N-Diethyl-4-hexylamino-benzamide 

[1]Wolfe,JohnP.;Buchwald,StephenL.[JournalofOrganicChemistry,1997,vol.62,#17,p.6066-6068]

[2]Wolfe,JohnP.;Buchwald,StephenL.[JournalofOrganicChemistry,1996,vol.61,#3,p.1133-1135]

77350-52-8    162883-19-4   
4-((3R,5R,8R,9S,10S,13S,14S,17S)-17-Acetyl-3-hydroxy-10,13-dimethyl-hexadecahydro-cyclopentaaphenanthren-3-ylethynyl)-N,N-diethyl-benzamide 

[1]Upasani,RavindraB.;Yang,KevinC.;Acosta-Burruel,Manuel;Konkoy,ChrisS.;McLellan,JamesA.;Woodward,RichardM.;Lan,NancyC.;Carter,RichardB.;Hawkinson,JonE.[JournalofMedicinalChemistry,1997,vol.40,#1,p.73-84]

Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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