1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)-
TL;DR: 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)- (CAS 87498-63-3) is a chemical compound with molecular formula C14H22N2 and molecular weight 218.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-phenylethyl)azepan-1-amine
Also Known As: N-phenethylazepan-1-amine, N-(2-Phenylethyl)azepan-1-amine, Hexahydro-N-(2-phenylethyl)-1H-azepin-1-amine, 1H-AZEPIN-1-AMINE, HEXAHYDRO-N-(2-PHENYLETHYL)-, RefChem:237342
| Molecular Formula | C14H22N2 |
|---|---|
| Molecular Weight | 218.18 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 218.1783 |
| Heavy Atoms | 16 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 87498-63-3 |
|---|---|
| SMILES | C1CCCN(CC1)NCCC2=CC=CC=C2 |
| InChIKey | WZBSDHBMXIILLL-UHFFFAOYSA-N |
Product Overview
1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)- (CAS 87498-63-3), with molecular formula C14H22N2 and molecular weight 218.18 g/mol. IUPAC: N-(2-phenylethyl)azepan-1-amine.
Chemical Property Profile of 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)-
Property Insights of 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)-
The XLogP value of 3.2 indicates that 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.3 Ų, 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)- has 1 hydrogen bond donor(s) and 2 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-Azepin-1-amine, hexahydro-N-(2-phenylethyl)-?
The CAS number of 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)- is 87498-63-3.
What is the molecular formula of 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)-?
The molecular formula of 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)- is C14H22N2.
What is the molecular weight of 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)-?
The molecular weight of 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)- is 218.18 g/mol.
Where can I buy 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)-?
You can request a quote for 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Azepin-1-amine, hexahydro-N-(2-phenylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.