BIAdb Drotaverin 2059

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BIAdb Drotaverin 2059
Systematic (IUPAC) name
(1Z)-1-[(3,4-diethoxyphenyl)methylidene]-6,7-diethoxy-3,4-dihydro-2H-isoquinoline hydrochloride
Identifiers
CAS number	?
ATC code	?
PubChem	6437861
Chemical data
Formula	C24H32ClNO4
Mol. mass	433.96818
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

Contents 1 Description 2 Source 3 Function 4 General Properties 5 External Links

[edit] Description

[edit] Source

Hungarian drug

[edit] Function

Spasmolytic

[edit] General Properties

*Molecular Weight

433.96818

*Exact Mass

433.201986

*Molecular Formula

C₂₄H₃₂ClNO₄

*IUPAC NAME

(1Z)-1-[(3,4-diethoxyphenyl)methylidene]-6,7-diethoxy-3,4-dihydro-2H-isoquinoline hydrochloride

*Canonical Smiles

CCOC1=C(C=C(C=C1)C=C2C3=CC(=C(C=C3CCN2)OCC)OCC)OCC.Cl

*Isomeric Smiles

CCOC1=C(C=C(C=C1)/C=C2/C3=CC(=C(C=C3CCN2)OCC)OCC)OCC.Cl

*XLogP

N/A

*Hydrogen bond donor

2

*Hydrogen bond acceptor

5

*Rotational Bond Count

9

*Topological Polar Surface Area

49

[edit] External Links

• Pubchem

Link to BIAdb Database