1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine
TL;DR: 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine (CAS 64058-22-6) is a chemical compound with molecular formula C19H30N2O and molecular weight 302.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azepan-1-yl)-2-ethoxy-2-phenyl-N-propylethanimine
Also Known As: 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine, 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexamethyleneimine, 1-(azepan-1-yl)-2-ethoxy-2-phenyl-N-propylethanimine, Hexahydro-1-[2-ethoxy-2-phenyl-1- ethyl]-1H-azepine, 1H-AZEPINE, HEXAHYDRO-1-(2-ETHOXY-2-PHENYL-N-PROPYLACETIMIDOYL)-
| Molecular Formula | C19H30N2O |
|---|---|
| Molecular Weight | 302.24 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 24.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 302.2358 |
| Heavy Atoms | 22 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 64058-22-6 |
|---|---|
| SMILES | CCCN=C(C(C1=CC=CC=C1)OCC)N2CCCCCC2 |
| InChIKey | BAZJSTYFKLUZCJ-UHFFFAOYSA-N |
Product Overview
1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine (CAS 64058-22-6), with molecular formula C19H30N2O and molecular weight 302.24 g/mol. IUPAC: 1-(azepan-1-yl)-2-ethoxy-2-phenyl-N-propylethanimine.
Chemical Property Profile of 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine
Property Insights of 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine
The XLogP value of 3.9 indicates that 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.8 Ų, 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine 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 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine?
The CAS number of 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine is 64058-22-6.
What is the molecular formula of 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine?
The molecular formula of 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine is C19H30N2O.
What is the molecular weight of 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine?
The molecular weight of 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine is 302.24 g/mol.
Where can I buy 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine?
You can request a quote for 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Ethoxy-2-phenyl-N-propylacetimidoyl)hexahydro-1H-azepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.