3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine
TL;DR: 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine (CAS 72536-45-9) is a chemical compound with molecular formula C23H26N2 and molecular weight 330.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine
Also Known As: 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine
| Molecular Formula | C23H26N2 |
|---|---|
| Molecular Weight | 330.21 g/mol |
| LogP | 5.1965 |
| Topological Polar Surface Area | 15.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.2096 |
| Heavy Atoms | 25 |
| Complexity | 753.1945 |
Chemical Identifiers
| CAS Number | 72536-45-9 |
|---|---|
| SMILES | CCN(CC)C1=NC=CC(=CC1CC2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine (CAS 72536-45-9), with molecular formula C23H26N2 and molecular weight 330.21 g/mol. IUPAC: 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine.
Chemical Property Profile of 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine
Property Insights of 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine
The XLogP value of 5.1965 indicates that 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-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, 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine?
The CAS number of 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine is 72536-45-9.
What is the molecular formula of 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine?
The molecular formula of 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine is C23H26N2.
What is the molecular weight of 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine?
The molecular weight of 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine is 330.21 g/mol.
Where can I buy 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine?
You can request a quote for 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-benzyl-N,N-diethyl-5-phenyl-3H-azepin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.