AC1N47ZC

ethyl 2-[(4-benzoylbenzoyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Also Known As: Oprea1_704725|SR-01000444620-1|F0496-0142|ethyl 2-(3-(4-benzoylbenzoyl)thioureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate|ethyl 2-({[(4-benzoylphenyl)formamido]methanethioyl}amino)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate|ethyl 2-[(4-benzoylbenzoyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate|Ethyl 3-[(4-benzoylbenzoyl)thiocarbamoylamino]-4-thiabicyclo[3.3.0]octa-2,9-diene-2-carboxylate

Molecular Formula	C25H22N2O4S2
Molecular Weight	478.1021 g/mol
LogP	4.7713
Topological Polar Surface Area	84.5 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	478.1021
Monoisotopic Mass	478.1021
Heavy Atoms	33
Complexity	1217.2089

Chemical Identifiers

CAS Number	391896-55-2
SMILES	CCOC(=O)C1=C(SC2=C1CCC2)NC(=S)NC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4