Basic information
- CAS
34144-68-8- Standard SMILES
CN1CCN(C2c3ccccc3CCc3ncccc32)CC1- InChIKey
RHEYABGOVGVPRA-UHFFFAOYSA-N- Molecular formula
- C19H23N3
- Average molar mass
- 293.4 g/mol
- Monoisotopic mass
- 293.18919775
Names & identifiers
- Preferred name
- 5H-Benzo(4,5)cyclohepta(1,2-b)pyridine, 10,11-dihydro-5-(4-methyl-1-piperazinyl)-
- IUPAC
- 2-(4-methylpiperazin-1-yl)-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaene
Names & synonyms
BRN 082221210,11-Dihydro-5-(4-methyl-1-piperazinyl)-5H-benzo(4,5)cyclohepta(1,2-b)pyridine34144-68-85-23-03-00084 (Beilstein Handbook Reference)5H-Benzo(4,5)cyclohepta(1,2-b)pyridine, 10,11-dihydro-5-(4-methyl-1-piperazinyl)-RefChem:305293DTXSID60955688AM-814/410916915-(4-methyl-1-piperazinyl)-10,11-dihydro-5H-benzo[4,5]cyclohepta[1,2-b]pyridine5-(4-Methylpiperazin-1-yl)-10,11-dihydro-5H-benzo[4,5]cyclohepta[1,2-b]pyridine
Database identifiers
- CAS
34144-68-8- PubChem CID
- 36700
- DTXSID
DTXSID60955688
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 19.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 364
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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