N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine
TL;DR: N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine (CAS 72536-43-7) is a chemical compound with molecular formula C17H22N2 and molecular weight 254.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-3-methyl-5-phenyl-3H-azepin-2-amine
Also Known As: N,N-diethyl-3-methyl-5-phenyl-3H-azepin-2-amine, N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine
| Molecular Formula | C17H22N2 |
|---|---|
| Molecular Weight | 254.18 g/mol |
| LogP | 3.9737 |
| Topological Polar Surface Area | 15.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.1783 |
| Heavy Atoms | 19 |
| Complexity | 493.25317 |
Chemical Identifiers
| CAS Number | 72536-43-7 |
|---|---|
| SMILES | CCN(CC)C1=NC=CC(=CC1C)C2=CC=CC=C2 |
Product Overview
N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine (CAS 72536-43-7), with molecular formula C17H22N2 and molecular weight 254.18 g/mol. IUPAC: N,N-diethyl-3-methyl-5-phenyl-3H-azepin-2-amine.
Chemical Property Profile of N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine
Property Insights of N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine
The XLogP value of 3.9737 indicates that N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.6 Ų, N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine has 0 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,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine?
The CAS number of N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine is 72536-43-7.
What is the molecular formula of N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine?
The molecular formula of N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine is C17H22N2.
What is the molecular weight of N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine?
The molecular weight of N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine is 254.18 g/mol.
Where can I buy N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine?
You can request a quote for N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-N-(3-methyl-5-phenyl-3H-azepin-2-yl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.