6314-42-7,MFCD00052505
Catalog No.:AA003UP3

6314-42-7 | Benzo[b]thiophene-2-carboxamide

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Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$76.00   $54.00
- +
5g
95%
in stock  
$273.00   $191.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003UP3
Chemical Name:
Benzo[b]thiophene-2-carboxamide
CAS Number:
6314-42-7
Molecular Formula:
C9H7NOS
Molecular Weight:
177.2230
MDL Number:
MFCD00052505
SMILES:
NC(=O)c1cc2c(s1)cccc2
NSC Number:
40286
Properties
Properties
 
Form:
Solid  
MP:
176-178°C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
195  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.1  

Downstream Synthesis Route

[1]Goettsch;Wiese[JournaloftheAmericanPharmaceuticalAssociation(1912),1958,vol.47,p.319,320]

[2]Chapleo,ChristopherB.;Myers,PeterL.;Butler,RichardC.M.;Davis,JohnA.;Doxey,JohnC.;etal.[JournalofMedicinalChemistry,1984,vol.27,#5,p.570-576]

[3]Yu,Yongshi;Tazeem;Xu,Zhichao;Du,Liaoqi;Jin,Mengyu;Dong,Chune;Zhou,Hai-Bing;Wu,Shuwen[MedChemComm,2019,vol.10,#1,p.89-100]

[1]JournaloftheAmericanChemicalSociety,1952,vol.74,p.664

[2]MedChemComm,2019,vol.10,p.89-100

[1]JournalofOrganicChemistry,2019

[2]JournalofOrganicChemistry,2019,vol.84,p.6084-6093

[3]OrganicLetters,2009,vol.11,p.2461-2464

[4]ChemicalCommunications,2009,p.4883-4885

[5]JournalofMedicinalChemistry,1984,vol.27,p.570-576

[1]Hritzova,Olga;Kutschy,Peter;Imrich,Jan;Schoeffmann,Thomas[CollectionofCzechoslovakChemicalCommunications,1987,vol.52,#11,p.2673-2679]

[2]Hritzova,Olga;Kutschy,Peter;Imrich,Jan;Schoeffmann,Thomas[CollectionofCzechoslovakChemicalCommunications,1987,vol.52,#11,p.2673-2679]

Literature

Title: Synthesis and evaluation of 1-(benzo[b]thiophen-2-yl)ethanone analogues as novel anti-osteoporosis agents acting on BMP-2 promotor.

Journal: Bioorganic & medicinal chemistry letters 20090801

Quotation Request
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SDS
Tags:6314-42-7 Molecular Formula|6314-42-7 MDL|6314-42-7 SMILES|6314-42-7 Benzo[b]thiophene-2-carboxamide
Catalog No.: AA003UP3
6314-42-7,MFCD00052505
6314-42-7 | Benzo[b]thiophene-2-carboxamide
Pack Size: 1g
Purity: 95%
in stock
$76.00 $54.00
Pack Size: 5g
Purity: 95%
in stock
$273.00 $191.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003UP3
Chemical Name: Benzo[b]thiophene-2-carboxamide
CAS Number: 6314-42-7
Molecular Formula: C9H7NOS
Molecular Weight: 177.2230
MDL Number: MFCD00052505
SMILES: NC(=O)c1cc2c(s1)cccc2
NSC Number: 40286
Properties
Form: Solid  
MP: 176-178°C  
Storage: Keep in dry area;2-8℃;  
Complexity: 195  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.1  
Downstream Synthesis Route
39827-11-7    6314-42-7 

[1]Goettsch;Wiese[JournaloftheAmericanPharmaceuticalAssociation(1912),1958,vol.47,p.319,320]

[2]Chapleo,ChristopherB.;Myers,PeterL.;Butler,RichardC.M.;Davis,JohnA.;Doxey,JohnC.;etal.[JournalofMedicinalChemistry,1984,vol.27,#5,p.570-576]

[3]Yu,Yongshi;Tazeem;Xu,Zhichao;Du,Liaoqi;Jin,Mengyu;Dong,Chune;Zhou,Hai-Bing;Wu,Shuwen[MedChemComm,2019,vol.10,#1,p.89-100]

6314-42-7    6314-43-8 

[1]JournaloftheAmericanChemicalSociety,1952,vol.74,p.664

[2]MedChemComm,2019,vol.10,p.89-100

6314-42-7    55219-11-9 

[1]JournalofOrganicChemistry,2019

[2]JournalofOrganicChemistry,2019,vol.84,p.6084-6093

[3]OrganicLetters,2009,vol.11,p.2461-2464

[4]ChemicalCommunications,2009,p.4883-4885

[5]JournalofMedicinalChemistry,1984,vol.27,p.570-576

115957-60-3    6314-42-7    103-72-0 

[1]Hritzova,Olga;Kutschy,Peter;Imrich,Jan;Schoeffmann,Thomas[CollectionofCzechoslovakChemicalCommunications,1987,vol.52,#11,p.2673-2679]

[2]Hritzova,Olga;Kutschy,Peter;Imrich,Jan;Schoeffmann,Thomas[CollectionofCzechoslovakChemicalCommunications,1987,vol.52,#11,p.2673-2679]

Literature fold

Title: Synthesis and evaluation of 1-(benzo[b]thiophen-2-yl)ethanone analogues as novel anti-osteoporosis agents acting on BMP-2 promotor.

Journal: Bioorganic & medicinal chemistry letters20090801

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