BIAdb NSC118072 2817

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BIAdb NSC118072 2817
Systematic (IUPAC) name
1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride
Identifiers
CAS number	?
ATC code	?
PubChem	16667431
Chemical data
Formula	C₂₀H₂₆ClNO₄
Mol. mass	379.87774
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

N/A

Unknown

*Molecular Weight

379.87774

*Exact Mass

379.155036

*Molecular Formula

C₂₀H₂₆ClNO₄

*IUPAC NAME

1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride

*Canonical Smiles

COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2)OC)OC)OC.Cl

*Isomeric Smiles

N/A

*XLogP

N/A

*Hydrogen bond donor

2

*Hydrogen bond acceptor

5

*Rotational Bond Count

6

*Topological Polar Surface Area

49