BIAdb 1-(4-aminobenzyl)isoquinoline 1019

Revision as of 05:24, 10 December 2009 by Neetikagambhir (Talk | contribs)

(diff) ←Older revision | Current revision (diff) | Newer revision→ (diff)

BIAdb 1-(4-aminobenzyl)isoquinoline 1019
Systematic (IUPAC) name
4-(phenylmethyl)isoquinolin-1-amine
Identifiers
CAS number	?
ATC code	?
PubChem	205985
Chemical data
Formula	C₁₆H₁₄N₂
Mol. mass	234.29576
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

Chemical Synthesis

Phosphodiesterase inhibitor

*Molecular Weight

234.29576

*Exact Mass

234.115698

*Molecular Formula

C₁₆H₁₄N₂

*IUPAC NAME

4-(phenylmethyl)isoquinolin-1-amine

*Canonical Smiles

C1=CC=C(C=C1)CC2=CN=C(C3=CC=CC=C32)N

*Isomeric Smiles

N/A

*XLogP

3.7

*Hydrogen bond donor

1

*Hydrogen bond acceptor

2

*Rotational Bond Count

2

*Topological Polar Surface Area

38.9