AC1NSMKT

4-[[2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]diazenyl]benzoic acid

Also Known As: KS-00004BN7|BAS 00469284|4-[(2Z)-2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]benzoic acid|4-[[2-[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]diazenyl]benzoic acid|4-{2-[1-[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}benzoic acid|4-[({1-[4-(4-methoxyphenyl)(1,3-thiazol-2-yl)]-3-(4-nitrophenyl)-5-oxo-1,2-dia zolin-4-ylidene}azamethyl)amino]benzoic acid|4-[(2E)-2-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxopyrazol-4-ylidene]hydrazinyl]benzoic acid|4-[(2Z)-2-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxopyrazol-4-ylidene]hydrazinyl]benzoic acid|4-[2-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxopyrazol-4-ylidene]hydrazinyl]benzoic acid|4-{2-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}benzoic aci

Molecular Formula	C26H18N6O6S
Molecular Weight	542.1008 g/mol
LogP	5.9865
Topological Polar Surface Area	165.07 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	9
Rotatable Bonds	8
Exact Mass	542.1008
Monoisotopic Mass	542.1008
Heavy Atoms	39
Complexity	1752.7245

Chemical Identifiers

CAS Number	314293-25-9
SMILES	COC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=C(N3)C4=CC=C(C=C4)[N+](=O)[O-])N=NC5=CC=C(C=C5)C(=O)O