2-cyano-3-[4-(N-phenylanilino)phenyl]prop-2-enoic acid

Modify Date: 2025-09-21 08:11:13

2-cyano-3-[4-(N-phenylanilino)phenyl]prop-2-enoic acid Structure
2-cyano-3-[4-(N-phenylanilino)phenyl]prop-2-enoic acid structure
Common Name 2-cyano-3-[4-(N-phenylanilino)phenyl]prop-2-enoic acid
CAS Number 30388-31-9 Molecular Weight 340.37500
Density N/A Boiling Point N/A
Molecular Formula C22H16N2O2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-cyano-3-[4-(N-phenylanilino)phenyl]prop-2-enoic acid

 Chemical & Physical Properties

Molecular Formula C22H16N2O2
Molecular Weight 340.37500
Exact Mass 340.12100
PSA 64.33000
LogP 5.14798
InChIKey DTGGJUIFYJXAJI-OBGWFSINSA-N
SMILES N#CC(=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O

 Synthetic Route

~82%

2-cyano-3-[4-(N-phenylanilino)phenyl]prop-2-enoic acid Structure

2-cyano-3-[4-(N...

CAS#:30388-31-9

Literature: Anthony, Savarimuthu Philip; Delaney, Colm; Varughese, Sunil; Wang, Longsheng; Draper, Sylvia M. CrystEngComm, 2011 , vol. 13, # 22 p. 6706 - 6711

~%

2-cyano-3-[4-(N-phenylanilino)phenyl]prop-2-enoic acid Structure

2-cyano-3-[4-(N...

CAS#:30388-31-9

Literature: Brown-Xu, Samantha E.; Chisholm, Malcolm H.; Durr, Christopher B.; Lewis, Sharlene A.; Naseri, Vesal; Spilker, Thomas F. Chemical Science, 2013 , vol. 4, # 5 p. 2105 - 2116

 Bioassay

View more

Name: Inhibition of actomyosin ATPase activity in bovine cardiac myofibrils assessed as red...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4841380
Name: Inhibition of actomyosin ATPase activity in bovine cardiac myofibrils assessed as red...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4841378
Name: Binding affinity to BME-bound [15N]-labelled cNTnC (1 to 90 residues)- cTnI (136 to 1...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4841388
Name: Reactivity with dithiothreitol in NMR buffer at 50 uM measured up to 24 hrs by 1D H-N...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4841387
Name: Stability of the compound in NMR buffer at 50 uM in the absence of DTT measured after...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4841386
Name: Binding affinity to BME-bound [15N]-labelled cNTnC (1 to 90 residues)- cTnI (136 to 1...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4841385
Name: Inhibition of MCT1-mediated lactate transport in rat RBE4 cells incubated for 15 mins...
Source: ChEMBL
Target: Monocarboxylate transporter 1
External Id: CHEMBL3584796
Name: Binding affinity to [15N]-labelled cNTnC (1 to 90 residues)- cTnI (136 to 163 residue...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4841376
Name: Drug degradation assessed as new spectra with MW of 404 Da formation at 40 uM measure...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4841390
Name: Drug degradation assessed as new spectra with MW of 202 Da formation at 40 uM measure...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4841389
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