AC1LUHLE structure

AC1LUHLE

N-(4-chlorophenyl)-2-[(8-propan-2-yl-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl)sulfanyl]acetamide

Also Known As: N-(4-chlorophenyl)-2-((5-isopropyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)thio)acetamide|N-(4-chlorophenyl)-2-{[5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}acetamide

CAS: 369404-21-7
Molecular Formula C24H23ClN4OS2
Molecular Weight 482.1002 g/mol
LogP 6.6259
Topological Polar Surface Area 67.77 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 5
Exact Mass 482.1002
Monoisotopic Mass 482.1002
Heavy Atoms 32
Complexity 1317.5763

Chemical Identifiers

CAS Number 369404-21-7
SMILES CC(C)C1=NC2=C(C3=C1CCCC3)C4=C(S2)C(=NC=N4)SCC(=O)NC5=CC=C(C=C5)Cl

Product Overview

AC1LUHLE (CAS 369404-21-7), with molecular formula C24H23ClN4OS2 and molecular weight 482.1002 g/mol. IUPAC: N-(4-chlorophenyl)-2-[(8-propan-2-yl-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl)sulfanyl]acetamide.

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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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