Compound C25H22ClNO2

1-benzyl-4-[(4-chlorophenyl)methyl]-6,7-dimethoxyisoquinoline

CAS: 62334-31-0

Molecular Formula	`C25H22ClNO2`
Molecular Weight	403.9 g/mol
LogP	6.6
Topological Polar Surface Area	31.4 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	6
Exact Mass	403.1339
Heavy Atoms	29
Complexity	489.0

Chemical Identifiers

CAS Number	62334-31-0
SMILES	`COC1=C(C=C2C(=C1)C(=CN=C2CC3=CC=CC=C3)CC4=CC=C(C=C4)Cl)OC`
InChIKey	`QFSYPUUAQODKGQ-UHFFFAOYSA-N`

📖 Product Overview

Compound C25H22ClNO2 (CAS: 62334-31-0) is a chemical compound with molecular formula C25H22ClNO2 and molecular weight 403.9 g/mol. Its IUPAC systematic name is 1-benzyl-4-[(4-chlorophenyl)methyl]-6,7-dimethoxyisoquinoline. LogP 6.6 Topological Polar Surface Area 31.4 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 6 Exact Mass 403.1339 Heavy Atoms 29 Complexity 489.0 InChI Key: QFSYPUUAQODKGQ-UHFFFAOYSA-N. SMILES: COC1=C(C=C2C(=C1)C(=CN=C2CC3=CC=CC=C3)CC4=CC=C(C=C4)Cl)OC.

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