AC1OACIA

4-[5-(6-methyl-2-oxo-4-phenyl-1H-quinolin-3-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid

Also Known As: 4-(3-(6-methyl-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl)-4-oxobutanoic acid|4-[3-(6-Methyl-2-oxo-4-phenyl-1,2-dihydro-quinolin-3-yl)-5-thiophen-2-yl-4,5-dihydro-pyrazol-1-yl]-4-oxo-butyric acid|4-[(3E)-3-(6-methyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-thiophen-2-yl-pyrazolidin-1-yl]-4-oxidanylidene-butanoic acid|4-[(3E)-3-(6-methyl-2-oxo-4-phenyl-3-quinolinylidene)-5-thiophen-2-yl-1-pyrazolidinyl]-4-oxobutanoic acid|4-[(3E)-3-(6-methyl-2-oxo-4-phenylquinolin-3-ylidene)-5-thiophen-2-ylpyrazolidin-1-yl]-4-oxobutanoic acid|4-[(3Z)-3-(6-methyl-2-oxo-4-phenylquinolin-3-ylidene)-5-thiophen-2-ylpyrazolidin-1-yl]-4-oxobutanoic acid|4-[3-(6-methyl-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid|4-[3-(6-methyl-2-oxo-4-phenylquinolin-3-ylidene)-5-thiophen-2-ylpyrazolidin-1-yl]-4-oxobutanoic acid|4-keto-4-[(3E)-3-(2-keto-6-methyl-4-phenyl-3-quinolylidene)-5-(2-thienyl)pyrazolidin-1-yl]butyric acid

Molecular Formula	C27H23N3O4S
Molecular Weight	485.14093 g/mol
LogP	5.10752
Topological Polar Surface Area	102.83 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	485.14093
Monoisotopic Mass	485.14093
Heavy Atoms	35
Complexity	1506.9736

Chemical Identifiers

CAS Number	799799-85-2
SMILES	CC1=CC2=C(C=C1)NC(=O)C(=C2C3=CC=CC=C3)C4=NN(C(C4)C5=CC=CS5)C(=O)CCC(=O)O