AC1LWSCK

ethyl 4-(4-chlorophenyl)-2-[(2,4-dinitrobenzoyl)amino]-5-methylthiophene-3-carboxylate

Also Known As: AK-968/40707917|ethyl 2-({2,4-bisnitrobenzoyl}amino)-4-(4-chlorophenyl)-5-methylthiophene-3-carboxylate|ethyl 4-(4-chlorophenyl)-2-[(2,4-dinitrobenzoyl)amino]-5-methylthiophene-3-carboxylate|ETHYL 4-(4-CHLOROPHENYL)-2-(2,4-DINITROBENZAMIDO)-5-METHYLTHIOPHENE-3-CARBOXYLATE|ETHYL 4-(4-CHLOROPHENYL)-2-[(2,4-DINITROBENZOYL)AMINO]-5-METHYL-3-THIOPHENECARBOXYLATE|ethyl 4-(4-chlorophenyl)-2-{[(2,4-dinitrophenyl)carbonyl]amino}-5-methylthiophene-3-carboxylate

Molecular Formula	C21H16ClN3O7S
Molecular Weight	489.03973 g/mol
LogP	5.62232
Topological Polar Surface Area	141.68 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	7
Exact Mass	489.03973
Monoisotopic Mass	489.03973
Heavy Atoms	33
Complexity	1271.6078

Chemical Identifiers

CAS Number	445005-04-9
SMILES	CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)Cl)C)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]