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128843-46-9,MFCD03791143
Catalog No.:AA000YC2

128843-46-9 | 2-Propenoic acid, 3-(4-benzoyl-1-methyl-1H-pyrrol-2-yl)-, (E)- (9CI)

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>95%
1 week  
$299.00   $209.00
- +
5mg
>95%
1 week  
$319.00   $223.00
- +
10mg
>95%
1 week  
$358.00   $250.00
- +
500mg
>95%
1 week  
$589.00   $412.00
- +
1g
>95%
1 week  
$813.00   $569.00
- +
5g
>95%
1 week  
$2,010.00   $1,407.00
- +
10g
>95%
1 week  
$3,206.00   $2,244.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000YC2
Chemical Name:
2-Propenoic acid, 3-(4-benzoyl-1-methyl-1H-pyrrol-2-yl)-, (E)- (9CI)
CAS Number:
128843-46-9
Molecular Formula:
C15H13NO3
Molecular Weight:
255.2686
MDL Number:
MFCD03791143
SMILES:
OC(=O)/C=C/c1cc(cn1C)C(=O)c1ccccc1
Properties
Computed Properties
 
Complexity:
372  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
2  

Downstream Synthesis Route

[1]Massa,S.;Artico,M.;Corelli,F.;Mai,A.;Santo,R.Di;etal.[JournalofMedicinalChemistry,1990,vol.33,#10,p.2845-2849]

[1]Massa,S.;Artico,M.;Corelli,F.;Mai,A.;Santo,R.Di;etal.[JournalofMedicinalChemistry,1990,vol.33,#10,p.2845-2849]

[2]Mai,Antonello;Massa,Silvio;Ragno,Rino;Cerbara,Ilaria;Jesacher,Florian;Loidl,Peter;Brosch,Gerald[JournalofMedicinalChemistry,2003,vol.46,#4,p.512-524]

[3]Massa;Mai;Sbardella;Esposito;Ragno;Loidl;Brosch[JournalofMedicinalChemistry,2001,vol.44,#13,p.2069-2072]

541-41-3    128843-46-9   
C18H17NO5 

[1]Mai,Antonello;Massa,Silvio;Ragno,Rino;Cerbara,Ilaria;Jesacher,Florian;Loidl,Peter;Brosch,Gerald[JournalofMedicinalChemistry,2003,vol.46,#4,p.512-524]

[2]Massa;Mai;Sbardella;Esposito;Ragno;Loidl;Brosch[JournalofMedicinalChemistry,2001,vol.44,#13,p.2069-2072]

[1]Mai,Antonello;Massa,Silvio;Ragno,Rino;Cerbara,Ilaria;Jesacher,Florian;Loidl,Peter;Brosch,Gerald[JournalofMedicinalChemistry,2003,vol.46,#4,p.512-524]

[2]Massa;Mai;Sbardella;Esposito;Ragno;Loidl;Brosch[JournalofMedicinalChemistry,2001,vol.44,#13,p.2069-2072]

[3]Massa,S.;Artico,M.;Corelli,F.;Mai,A.;Santo,R.Di;etal.[JournalofMedicinalChemistry,1990,vol.33,#10,p.2845-2849]

[1]Mai,Antonello;Massa,Silvio;Ragno,Rino;Cerbara,Ilaria;Jesacher,Florian;Loidl,Peter;Brosch,Gerald[JournalofMedicinalChemistry,2003,vol.46,#4,p.512-524]

Literature

Title: Synthesis and antimicrobial and cytotoxic activities of pyrrole-containing analogues of trichostatin A.

Journal: Journal of medicinal chemistry 19901001

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SDS
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Tags:128843-46-9 Molecular Formula|128843-46-9 MDL|128843-46-9 SMILES|128843-46-9 2-Propenoic acid, 3-(4-benzoyl-1-methyl-1H-pyrrol-2-yl)-, (E)- (9CI)