3-(azepan-1-yl)-N-(4-bromophenyl)propanamide
TL;DR: 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide (CAS 428503-45-1) is a chemical compound with molecular formula C15H21BrN2O and molecular weight 324.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(azepan-1-yl)-N-(4-bromophenyl)propanamide
Also Known As: 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide, 3-azaperhydroepinyl-N-(4-bromophenyl)propanamide, AB00109128-01, 3-(1-AZEPANYL)-N~1~-(4-BROMOPHENYL)PROPANAMIDE
| Molecular Formula | C15H21BrN2O |
|---|---|
| Molecular Weight | 324.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.08374 |
| Heavy Atoms | 19 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 428503-45-1 |
|---|---|
| SMILES | C1CCCN(CC1)CCC(=O)NC2=CC=C(C=C2)Br |
| InChIKey | SJOMKYDSIHVKBP-UHFFFAOYSA-N |
Product Overview
3-(azepan-1-yl)-N-(4-bromophenyl)propanamide (CAS 428503-45-1), with molecular formula C15H21BrN2O and molecular weight 324.08 g/mol. IUPAC: 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide.
Chemical Property Profile of 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide
Property Insights of 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide
The XLogP value of 3.0 indicates that 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide 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 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide?
The CAS number of 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide is 428503-45-1.
What is the molecular formula of 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide?
The molecular formula of 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide is C15H21BrN2O.
What is the molecular weight of 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide?
The molecular weight of 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide is 324.08 g/mol.
Where can I buy 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide?
You can request a quote for 3-(azepan-1-yl)-N-(4-bromophenyl)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-(4-bromophenyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(azepan-1-yl)-N-(4-bromophenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.