AC1LJMQ7

2-chloro-4-[3-[(E)-[1-(2-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2,5-dimethylpyrrol-1-yl]benzoic acid

Also Known As: AN-988/15132018|2-chloro-4-[3-[(E)-[1-(2-fluorophenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2,5-dimethylpyrrol-1-yl]benzoic acid|2-chloro-4-{3-[(1-(2-fluorophenyl)-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoic acid|(E)-2-chloro-4-(3-((1-(2-fluorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid

Molecular Formula	C24H17ClFN3O4S
Molecular Weight	497.06122 g/mol
LogP	4.41614
Topological Polar Surface Area	91.64 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	497.06122
Monoisotopic Mass	497.06122
Heavy Atoms	34
Complexity	1429.5664

Chemical Identifiers

CAS Number	425683-92-7
SMILES	CC1=CC(=C(N1C2=CC(=C(C=C2)C(=O)O)Cl)C)/C=C/3\C(=O)NC(=S)N(C3=O)C4=CC=CC=C4F