N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
TL;DR: N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine (CAS 802607-27-8) is a chemical compound with molecular formula C13H18N2 and molecular weight 202.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
Also Known As: N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine, 1H-Azepine, hexahydro-2-(o-tolylimino)- (8CI), 3,4,5,6-Tetrahydro-N-(2-methylphenyl)-2H-azepin-7-amine, N-(2-methylphenyl)-4,5,6,7-tetrahydro-3H-azepin-2-amine
| Molecular Formula | C13H18N2 |
|---|---|
| Molecular Weight | 202.15 g/mol |
| LogP | 3.37942 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 202.147 |
| Heavy Atoms | 15 |
| Complexity | 355.3085 |
Chemical Identifiers
| CAS Number | 802607-27-8 |
|---|---|
| SMILES | CC1=CC=CC=C1NC2=NCCCCC2 |
Product Overview
N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine (CAS 802607-27-8), with molecular formula C13H18N2 and molecular weight 202.15 g/mol. IUPAC: N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine.
Chemical Property Profile of N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
Property Insights of N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
The XLogP value of 3.37942 indicates that N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.39 Ų, N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine 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 N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine?
The CAS number of N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine is 802607-27-8.
What is the molecular formula of N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine?
The molecular formula of N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine is C13H18N2.
What is the molecular weight of N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine?
The molecular weight of N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine is 202.15 g/mol.
Where can I buy N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine?
You can request a quote for N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.