1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride
TL;DR: 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride (CAS 33073-60-8) is a chemical compound with molecular formula C15H24ClN and molecular weight 253.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-phenylpropan-2-yl)azepane;hydrochloride
Also Known As: Bo 720 hydrochloride, KST-1B3162, 1-(1-phenylpropan-2-yl)azepane hydrochloride(1:1), Phenyl-3 hexamethylenimine-2 propane chlorhydrate, 1-(1-phenylpropan-2-yl)azepane hydrochloride
| Molecular Formula | C15H24ClN |
|---|---|
| Molecular Weight | 253.16 g/mol |
| LogP | 3.9154 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.15973 |
| Heavy Atoms | 17 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 33073-60-8 |
|---|---|
| SMILES | CC(CC1=CC=CC=C1)N2CCCCCC2.Cl |
| InChIKey | LBBBUXHHFSIFNO-UHFFFAOYSA-N |
Product Overview
1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride (CAS 33073-60-8), with molecular formula C15H24ClN and molecular weight 253.16 g/mol. IUPAC: 1-(1-phenylpropan-2-yl)azepane;hydrochloride.
Chemical Property Profile of 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride
Property Insights of 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride
The XLogP value of 3.9154 indicates that 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, 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 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride?
The CAS number of 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride is 33073-60-8.
What is the molecular formula of 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride?
The molecular formula of 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride is C15H24ClN.
What is the molecular weight of 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride?
The molecular weight of 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride is 253.16 g/mol.
Where can I buy 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride?
You can request a quote for 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1H-Azepine, hexahydro-1-(1-methyl-2-phenylethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.