BIAdb Papaverine 2906

BIAdb Papaverine 2906
Systematic (IUPAC) name
1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline hydrochloride
Identifiers
CAS number	?
ATC code	?
PubChem	6084
Chemical data
Formula	C₂₀H₂₂ClNO₄
Mol. mass	375.84598
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

Papaver somniferum

Antitussive

*Molecular Weight

375.84598

*Exact Mass

375.123736

*Molecular Formula

C₂₀H₂₂ClNO₄

*IUPAC NAME

1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline hydrochloride

*Canonical Smiles

COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.Cl

*Isomeric Smiles

N/A

*XLogP

N/A

*Hydrogen bond donor

1

*Hydrogen bond acceptor

5

*Rotational Bond Count

6

*Topological Polar Surface Area

49.8