AC1LYRU5 structure

AC1LYRU5

17-(1,3-benzodioxol-5-ylmethyl)-13-[(2-chlorophenyl)methyl]-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one

Also Known As: 11-(1,3-benzodioxol-5-ylmethyl)-3-(2-chlorobenzyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one|11-(benzo[d][1,3]dioxol-5-ylmethyl)-3-(2-chlorobenzyl)-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one

CAS: 839701-01-8
Molecular Formula C27H18ClN5O3
Molecular Weight 495.1098 g/mol
LogP 4.7731
Topological Polar Surface Area 84.06 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 495.1098
Monoisotopic Mass 495.1098
Heavy Atoms 36
Complexity 1877.7635

Chemical Identifiers

CAS Number 839701-01-8
SMILES C1OC2=C(O1)C=C(C=C2)CN3C4=C(C5=NC6=CC=CC=C6N=C53)C(=O)N(C=N4)CC7=CC=CC=C7Cl

Product Overview

AC1LYRU5 (CAS 839701-01-8), with molecular formula C27H18ClN5O3 and molecular weight 495.1098 g/mol. IUPAC: 17-(1,3-benzodioxol-5-ylmethyl)-13-[(2-chlorophenyl)methyl]-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one.

🧪
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.
View MSDS →

AC1LYRU5 is a custom synthesis product. We offer services from milligram to kilogram scale.

Request a Quote »
🤖 CoreyChem AI 助手 ×
您好!我是 CoreyChem AI 助手。可以问我产品搜索、询价、样品或技术问题。如何帮助您?