AC1MV1XV

ethyl 2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-[(2-chlorobenzoyl)amino]-3,3,3-trifluoropropanoate

Also Known As: AG-389/13258022|SR-01000526827-1|A2131/0089475|ethyl 2-((3-carbamoyl-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-2-(2-chlorobenzamido)-3,3,3-trifluoropropanoate|ethyl 2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-[(2-chlorobenzoyl)amino]-3,3,3-trifluoropropanoate|ethyl 2-[(3-carbamoyl(4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl))amino]-2-[(2-ch lorophenyl)carbonylamino]-3,3,3-trifluoropropanoate|ETHYL 2-[(3-CARBAMOYL-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-2-YL)AMINO]-2-[(2-CHLOROPHENYL)FORMAMIDO]-3,3,3-TRIFLUOROPROPANOATE|ethyl 2-{[3-(aminocarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]amino}-2-[(2-chlorobenzoyl)amino]-3,3,3-trifluoropropanoate|ethyl N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[(2-chlorophenyl)carbonyl]amino}-3,3,3-trifluoroalaninate

Molecular Formula	C21H21ClF3N3O4S
Molecular Weight	503.08932 g/mol
LogP	4.0428
Topological Polar Surface Area	110.52 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	7
Exact Mass	503.08932
Monoisotopic Mass	503.08932
Heavy Atoms	33
Complexity	1089.1925

Chemical Identifiers

CAS Number	298683-75-7
SMILES	CCOC(=O)C(C(F)(F)F)(NC1=C(C2=C(S1)CCCC2)C(=O)N)NC(=O)C3=CC=CC=C3Cl