Piperazine, 1-((4,6-dihydro-4-oxo-3-phenylpyrido(2,1-a)isoindol-1-yl)carbonyl)-4-methyl-, monohydrochloride
Basic information
- CAS
141388-94-5- Standard SMILES
CN1CCN(C(=O)c2cc(-c3ccccc3)c(=O)n3c2-c2ccccc2C3)CC1.Cl- InChIKey
ALKFOJVRDNKBSG-UHFFFAOYSA-N- Molecular formula
- C24H24ClN3O2
- Average molar mass
- 421.9 g/mol
- Monoisotopic mass
- 421.1557047
Names & identifiers
- Preferred name
- Piperazine, 1-((4,6-dihydro-4-oxo-3-phenylpyrido(2,1-a)isoindol-1-yl)carbonyl)-4-methyl-, monohydrochloride
- IUPAC
- 1-(4-methylpiperazine-1-carbonyl)-3-phenyl-6H-pyrido[2,1-a]isoindol-4-one;hydrochloride
Names & synonyms
141388-94-5Piperazine, 1-((4,6-dihydro-4-oxo-3-phenylpyrido(2,1-a)isoindol-1-yl)carbonyl)-4-methyl-, monohydrochlorideDTXSID80161709RefChem:371796DTXCID2084200SCHEMBL96834301-(4-Methylpiperazine-1-carbonyl)-3-phenylpyrido[2,1-a]isoindol-4(6H)-one--hydrogen chloride (1/1)
Database identifiers
- CAS
141388-94-5- PubChem CID
- 3072287
- DTXSID
DTXSID80161709
Properties
Computed structural properties
- Topological polar surface area
- 43.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 741
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…