BIAdb Sanguinarine analogue,41 3207

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BIAdb Sanguinarine analogue,41 3207
Systematic (IUPAC) name
8-(2-methoxyethyl)-5-methyl-[1,3]dioxolo[4,5-i]phenanthridin-5-iumchloride
Identifiers
CAS number	?
ATC code	?
PubChem	25093285
Chemical data
Formula	C₁₈H₁₈ClNO₃
Mol. mass	331.79342
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

N/A

Unknown

*Molecular Weight

331.79342

*Exact Mass

331.097521

*Molecular Formula

C₁₈H₁₈ClNO₃

*IUPAC NAME

8-(2-methoxyethyl)-5-methyl-[1,3]dioxolo[4,5-i]phenanthridin-5-iumchloride

*Canonical Smiles

C[N+]1=C2C=CC(=CC2=C3C=CC4=C(C3=C1)OCO4)CCOC.[Cl-]

*Isomeric Smiles

N/A

*XLogP

N/A

*Hydrogen bond donor

0

*Hydrogen bond acceptor

4

*Rotational Bond Count

3

*Topological Polar Surface Area

31.6