AC1LX49E structure

AC1LX49E

methyl 2-[[2-(4-chlorophenyl)acetyl]amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate

Also Known As: Oprea1_563376|AK-968/12975599|methyl 2-[[2-(4-chlorophenyl)acetyl]amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate|methyl 2-{[(4-chlorophenyl)acetyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate|methyl 2-[2-(4-chlorophenyl)acetylamino]-4,5,6,7,8,9-hexahydrocycloocta[2,1-b] thiophene-3-carboxylate

CAS: 543717-47-1
Molecular Formula C20H22ClNO3S
Molecular Weight 391.1009 g/mol
LogP 5.0283
Topological Polar Surface Area 55.4 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 391.1009
Monoisotopic Mass 391.1009
Heavy Atoms 26
Complexity 798.1328

Chemical Identifiers

CAS Number 543717-47-1
SMILES COC(=O)C1=C(SC2=C1CCCCCC2)NC(=O)CC3=CC=C(C=C3)Cl

Product Overview

AC1LX49E (CAS 543717-47-1), with molecular formula C20H22ClNO3S and molecular weight 391.1009 g/mol. IUPAC: methyl 2-[[2-(4-chlorophenyl)acetyl]amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate.

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