AC1M3CO6

methyl 3-chloro-6-[(2-phenylphenyl)carbamothioylamino]-1-benzothiophene-2-carboxylate

Also Known As: methyl 3-chloro-6-[(2-phenylphenyl)carbamothioylamino]-1-benzothiophene-2-carboxylate|methyl 6-(3-([1,1'-biphenyl]-2-yl)thioureido)-3-chlorobenzo[b]thiophene-2-carboxylate|methyl 6-[(biphenyl-2-ylcarbamothioyl)amino]-3-chloro-1-benzothiophene-2-carboxylate|methyl 3-chloro-6-({[(2-phenylphenyl)amino]thioxomethyl}amino)benzo[b]thiophen e-2-carboxylate

Molecular Formula	C23H17ClN2O2S2
Molecular Weight	452.042 g/mol
LogP	6.8172
Topological Polar Surface Area	50.36 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	452.042
Monoisotopic Mass	452.042
Heavy Atoms	30
Complexity	1238.6807

Chemical Identifiers

CAS Number	708221-91-4
SMILES	COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=S)NC3=CC=CC=C3C4=CC=CC=C4)Cl