AC1NDP8A

2-[(3-ethoxycarbonyl-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid

Also Known As: Oprea1_590504|AK-968/37220043|2-((3-(ethoxycarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)carbamoyl)cyclohexanecarboxylic acid|2-[(3-ethoxycarbonyl-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid|2-{[3-(ethoxycarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl]carbamoyl}cyclohexanecarboxylic acid|cycloocta[b]thiophene-3-carboxylic acid, 2-[[(2-carboxycyclohexyl)carbonyl]amino]-4,5,6,7,8,9-hexahydro-, 3-ethyl ester|2-([[3-(ETHOXYCARBONYL)-4,5,6,7,8,9-HEXAHYDROCYCLOOCTA[B]THIEN-2-YL]AMINO]CARBONYL)CYCLOHEXANECARBOXYLIC ACID|2-({[3-(ethoxycarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl]amino}carbonyl)cyclohexanecarboxylic acid|2-({[3-(ETHOXYCARBONYL)-4,5,6,7,8,9-HEXAHYDROCYCLOOCTA[B]THIOPHEN-2-YL]AMINO}CARBONYL)-1-CYCLOHEXANECARBOXYLIC ACID

Molecular Formula	C21H29NO5S
Molecular Weight	407.17664 g/mol
LogP	4.4133
Topological Polar Surface Area	92.7 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	407.17664
Monoisotopic Mass	407.17664
Heavy Atoms	28
Complexity	741.39954

Chemical Identifiers

CAS Number	354547-07-2
SMILES	CCOC(=O)C1=C(SC2=C1CCCCCC2)NC(=O)C3CCCCC3C(=O)O