AC1LWZC2

methyl 2-[[3-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-3-oxopropanoyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Also Known As: Oprea1_111165|AF-399/40851183|F1174-3062|methyl 2-[[3-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-3-oxopropanoyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate|dimethyl 2,2'-(malonylbis(azanediyl))bis(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate)|METHYL 2-(2-{[3-(METHOXYCARBONYL)-4H,5H,6H,7H,8H-CYCLOHEPTA[B]THIOPHEN-2-YL]CARBAMOYL}ACETAMIDO)-4H,5H,6H,7H,8H-CYCLOHEPTA[B]THIOPHENE-3-CARBOXYLATE|methyl 2-[(3-{[3-(methoxycarbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl]amino}-3-oxopropanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Molecular Formula	C25H30N2O6S2
Molecular Weight	518.15454 g/mol
LogP	4.8879
Topological Polar Surface Area	110.8 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	8
Rotatable Bonds	6
Exact Mass	518.15454
Monoisotopic Mass	518.15454
Heavy Atoms	35
Complexity	1061.2535

Chemical Identifiers

CAS Number	379236-89-2
SMILES	COC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CC(=O)NC3=C(C4=C(S3)CCCCC4)C(=O)OC