Compound C27H28ClN3O2

3-chloro-N-[[1-(1H-indol-3-ylmethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]aniline

CAS: 84218-38-2

Molecular Formula	`C27H28ClN3O2`
Molecular Weight	462.0 g/mol
LogP	6.3
Topological Polar Surface Area	49.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	461.187
Heavy Atoms	33
Complexity	624.0

Chemical Identifiers

CAS Number	84218-38-2
SMILES	`COC1=C(C=C2C(N(CCC2=C1)CNC3=CC(=CC=C3)Cl)CC4=CNC5=CC=CC=C54)OC`
InChIKey	`VJEMUTOQHQQABF-UHFFFAOYSA-N`

📖 Product Overview

Compound C27H28ClN3O2 (CAS: 84218-38-2) is a chemical compound with molecular formula C27H28ClN3O2 and molecular weight 462.0 g/mol. Its IUPAC systematic name is 3-chloro-N-[[1-(1H-indol-3-ylmethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]aniline. LogP 6.3 Topological Polar Surface Area 49.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 461.187 Heavy Atoms 33 Complexity 624.0 InChI Key: VJEMUTOQHQQABF-UHFFFAOYSA-N. SMILES: COC1=C(C=C2C(N(CCC2=C1)CNC3=CC(=CC=C3)Cl)CC4=CNC5=CC=CC=C54)OC.

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