AC1LLNRR structure

AC1LLNRR

N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-chloro-1-benzothiophene-2-carboxamide

Also Known As: Oprea1_424353|Oprea1_718509|KS-00003W20|BAS 00727621|N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-chloro-1-benzothiophene-2-carboxamide|AB00093978-01|AG-690/11835138|F0359-0230|N-(3-carbamoyl-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-3-chlorobenzo[b]thiophene-2-carboxamide|N-[3-(aminocarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]-3-chloro-1-benzothiophene-2-carboxamide|2-[(3-chlorobenzo[b]thiophen-2-yl)carbonylamino]-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxamide|N-[3-(aminocarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]-3-chloro-1-benzo[b]thiophene-2-carboxamide

CAS: 331979-85-2
Molecular Formula C18H15ClN2O2S2
Molecular Weight 390.02634 g/mol
LogP 4.8462
Topological Polar Surface Area 72.19 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 3
Exact Mass 390.02634
Monoisotopic Mass 390.02634
Heavy Atoms 25
Complexity 1006.08765

Chemical Identifiers

CAS Number 331979-85-2
SMILES C1CCC2=C(C1)C(=C(S2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C(=O)N

Product Overview

AC1LLNRR (CAS 331979-85-2), with molecular formula C18H15ClN2O2S2 and molecular weight 390.02634 g/mol. IUPAC: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-chloro-1-benzothiophene-2-carboxamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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