BIAdb 3,4-dihydropapaverine 1040

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BIAdb 3,4-dihydropapaverine 1040
Systematic (IUPAC) name
1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline
Identifiers
CAS number	?
ATC code	?
PubChem	22176
Chemical data
Formula	C₂₀H₂₃NO₄
Mol. mass	341.40092
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

N/A

Unknown

*Molecular Weight

341.40092

*Exact Mass

341.162708

*Molecular Formula

C₂₀H₂₃NO₄

*IUPAC NAME

1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinoline

*Canonical Smiles

COC1=C(C=C(C=C1)CC2=NCCC3=CC(=C(C=C32)OC)OC)OC

*Isomeric Smiles

N/A

*XLogP

3.1

*Hydrogen bond donor

0

*Hydrogen bond acceptor

5

*Rotational Bond Count

6

*Topological Polar Surface Area

49.3