3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide
TL;DR: 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide (CAS 428832-18-2) is a chemical compound with molecular formula C17H26N2O3 and molecular weight 306.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide
Also Known As: 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide, BAS 03086642, AB00109532-01, AT-057/43314128, 3-(1-azepanyl)-N-(2,4-dimethoxyphenyl)propanamide
| Molecular Formula | C17H26N2O3 |
|---|---|
| Molecular Weight | 306.19 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 306.19434 |
| Heavy Atoms | 22 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 428832-18-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NC(=O)CCN2CCCCCC2)OC |
| InChIKey | OETZBEVTTLDZEY-UHFFFAOYSA-N |
Product Overview
3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide (CAS 428832-18-2), with molecular formula C17H26N2O3 and molecular weight 306.19 g/mol. IUPAC: 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide.
Chemical Property Profile of 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide
Property Insights of 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide. With a topological polar surface area (TPSA) of 50.8 Ų, 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide has 1 hydrogen bond donor(s) and 4 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 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide?
The CAS number of 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide is 428832-18-2.
What is the molecular formula of 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide?
The molecular formula of 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide is C17H26N2O3.
What is the molecular weight of 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide?
The molecular weight of 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide is 306.19 g/mol.
Where can I buy 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide?
You can request a quote for 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(azepan-1-yl)-N-(2,4-dimethoxyphenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.