RefChem:349745
1-(3-benzo[b][1]benzazepin-11-ylpropyl)-4-phenylpiperidine-4-carbonitrile;hydrochloride
Also Known As: KST-1B3288|1-(3-(5H-Dibenz(b,f)azepin-5-yl)propyl)-4-phenylisonipecotonitrile hydrochloride hydrate|Isonipecotonitrile, 1-(3-(5H-dibenz(b,f)azepin-5-yl)propyl)-4-phenyl-, monohydrochloride, hydrate|1-[3-(5h-dibenzo[b,f]azepin-5-yl)propyl]-4-phenylpiperidine-4-carbonitrile hydrochloride(1:1)|1-(3-benzo[b][1]benzazepin-11-ylpropyl)-4-phenylpiperidine-4-carbonitrile hydrochloride|1-(3-benzo[b][1]benzazepin-11-ylpropyl)-4-phenylpiperidine-4-carbonitrile,hydrochloride|1-[3-(5H-Dibenzo[b,f]azepin-5-yl)propyl]-4-phenylpiperidine-4-carbonitrile--hydrogen chloride (1/1)|4-Piperidinecarbonitrile,1-[3-(5H-dibenz[b,f]azepin-5-yl)propyl]-4-phenyl-, hydrochloride (1:1)
| Molecular Formula | C29H30ClN3 |
|---|---|
| Molecular Weight | 455.21283 g/mol |
| LogP | 6.67778 |
| Topological Polar Surface Area | 30.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 455.21283 |
| Monoisotopic Mass | 455.21283 |
| Heavy Atoms | 33 |
| Complexity | 650.0 |
Chemical Identifiers
| CAS Number | 337-29-1 |
|---|---|
| SMILES | C1CN(CCC1(C#N)C2=CC=CC=C2)CCCN3C4=CC=CC=C4C=CC5=CC=CC=C53.Cl |
| InChIKey | JRJBDKMNZJPNCF-UHFFFAOYSA-N |
Product Overview
RefChem:349745 (CAS 337-29-1), with molecular formula C29H30ClN3 and molecular weight 455.21283 g/mol. IUPAC: 1-(3-benzo[b][1]benzazepin-11-ylpropyl)-4-phenylpiperidine-4-carbonitrile;hydrochloride.