AC1LMILS

methyl 2-[(3-chlorobenzoyl)amino]-4-methyl-5-[(3-methylphenyl)carbamoyl]thiophene-3-carboxylate

Also Known As: Oprea1_411563|Oprea1_851165|BAS 02496734|Methyl 2-(3-chlorobenzamido)-4-methyl-5-(m-tolylcarbamoyl)thiophene-3-carboxylate|Methyl2-(3-chlorobenzamido)-4-methyl-5-(m-tolylcarbamoyl)thiophene-3-carboxylate|2-(3-Chloro-benzoylamino)-4-methyl-5-m-tolylcarbamoyl-thiophene-3-carboxylic acid methyl ester|methyl 2-[(3-chlorobenzoyl)amino]-4-methyl-5-[(3-methylphenyl)carbamoyl]thiophene-3-carboxylate

Molecular Formula	C22H19ClN2O4S
Molecular Weight	442.0754 g/mol
LogP	5.30954
Topological Polar Surface Area	84.5 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	442.0754
Monoisotopic Mass	442.0754
Heavy Atoms	30
Complexity	1139.9163

Chemical Identifiers

CAS Number	335406-72-9
SMILES	CC1=CC(=CC=C1)NC(=O)C2=C(C(=C(S2)NC(=O)C3=CC(=CC=C3)Cl)C(=O)OC)C