Basic information
- CAS
56208-01-6- Standard SMILES
CC(C)=CCCC(C)=CCCC(C)=CCN1CCN(Cc2ccc3c(c2)OCO3)CC1- InChIKey
DVJCPEWCHQLAEH-UHFFFAOYSA-N- Molecular formula
- C27H40N2O2
- Average molar mass
- 424.6 g/mol
- Monoisotopic mass
- 424.30897852
Overview
Pifarnine is a member of the class of benzodioxoles that is 1,3-benzodioxole substituted by a [4-(3,7,11-trimethyldodeca-2,6,10-trien-1-yl)piperazin-1-yl]methyl group at position 5. It is an anti-ulcer agent. It has a role as an anti-ulcer drug. It is a member of benzodioxoles, a N-alkylpiperazine and an olefinic compound.
Names & identifiers
- Preferred name
- Pifazin
- IUPAC
- 1-(1,3-benzodioxol-5-ylmethyl)-4-(3,7,11-trimethyldodeca-2,6,10-trienyl)piperazine
Names & synonyms
pifazin1-(1,3-benzodioxol-5-ylmethyl)-4-(3,7,11-trimethyldodeca-2,6,10-trienyl)piperazineU-27DTXSID20866544U271-(1,3-benzodioxol-5-ylmethyl)-4-(3,7,11-trimethyldodeca-2,6,10-trien-1-yl)piperazine1-[(2H-1,3-Benzodioxol-5-yl)methyl]-4-(3,7,11-trimethyldodeca-2,6,10-trien-1-yl)piperazine
Database identifiers
- CAS
56208-01-6- PubChem CID
- 65455
- DTXSID
DTXSID20866544- ChEBI
CHEBI:135687
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 627
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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