CTK4H6935

4-[2-[4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]phenyl]sulfonylethoxy]-4-oxobut-2-enoic acid

Also Known As: 2-Butenedioic acid(2Z)-,mono[2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]ethyl]ester (9CI)

Molecular Formula	C21H19ClN2O6S
Molecular Weight	462.06525 g/mol
LogP	2.91
Topological Polar Surface Area	113.34 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	462.06525
Heavy Atoms	31
Complexity	1125.5

Chemical Identifiers

CAS Number	3663-96-5
SMILES	C1CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)CCOC(=O)C=CC(=O)O