1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride
TL;DR: 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride (CAS 54794-46-6) is a chemical compound with molecular formula C16H18ClN and molecular weight 259.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine;hydrochloride
Also Known As: 1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine, 1-phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride, 1-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine hydrochloride, 5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrochloride, 5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine;hydrochloride
| Molecular Formula | C16H18ClN |
|---|---|
| Molecular Weight | 259.11 g/mol |
| LogP | 3.386 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 259.11276 |
| Heavy Atoms | 18 |
| Complexity | 495.45996 |
Chemical Identifiers
| CAS Number | 54794-46-6 |
|---|---|
| SMILES | C1CNCC(C2=CC=CC=C21)C3=CC=CC=C3.Cl |
Product Overview
1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride (CAS 54794-46-6), with molecular formula C16H18ClN and molecular weight 259.11 g/mol. IUPAC: 5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine;hydrochloride.
Chemical Property Profile of 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride
Property Insights of 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride
The XLogP value of 3.386 indicates that 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride?
The CAS number of 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride is 54794-46-6.
What is the molecular formula of 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride?
The molecular formula of 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride is C16H18ClN.
What is the molecular weight of 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride?
The molecular weight of 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride is 259.11 g/mol.
Where can I buy 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride?
You can request a quote for 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-2,3,4,5-tetrahydro-1h-3-benzazepine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.