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727980-91-8,MFCD06334205
Catalog No.:AA01B63U

727980-91-8 | 4-cyanophenyl 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$493.00   $345.00
- +
100mg
95%
3 weeks  
$681.00   $477.00
- +
250mg
95%
3 weeks  
$922.00   $645.00
- +
500mg
95%
3 weeks  
$1,388.00   $972.00
- +
1g
95%
3 weeks  
$1,747.00   $1,223.00
- +
2.5g
95%
3 weeks  
$3,313.00   $2,319.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA01B63U
Chemical Name:
4-cyanophenyl 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanoate
CAS Number:
727980-91-8
Molecular Formula:
C18H12N2O4
Molecular Weight:
320.2989
MDL Number:
MFCD06334205
SMILES:
N#Cc1ccc(cc1)OC(=O)C(N1C(=O)c2c(C1=O)cccc2)C
Properties
Computed Properties
 
Complexity:
561  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
2.5  

Literature

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

Journal: Bioorganic & medicinal chemistry letters 20101101

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Tags:727980-91-8 Molecular Formula|727980-91-8 MDL|727980-91-8 SMILES|727980-91-8 4-cyanophenyl 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanoate