N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide
TL;DR: N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide (CAS 519004-84-3) is a chemical compound with molecular formula C17H27N3O and molecular weight 289.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide
Also Known As: BAS 03087029, N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide, AT-057/43314993, N-(3,5-dimethylphenyl)-3-(4-ethylpiperazinyl)propanamide, N-(3,5-dimethylphenyl)-3-(4-ethyl-1-piperazinyl)propanamide
| Molecular Formula | C17H27N3O |
|---|---|
| Molecular Weight | 289.22 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 289.21542 |
| Heavy Atoms | 21 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 519004-84-3 |
|---|---|
| SMILES | CCN1CCN(CC1)CCC(=O)NC2=CC(=CC(=C2)C)C |
| InChIKey | YDQCXTHLKWRTPB-UHFFFAOYSA-N |
Product Overview
N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide (CAS 519004-84-3), with molecular formula C17H27N3O and molecular weight 289.22 g/mol. IUPAC: N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide.
Chemical Property Profile of N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide
Property Insights of N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide. With a topological polar surface area (TPSA) of 35.6 Ų, N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide has 1 hydrogen bond donor(s) and 3 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-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide?
The CAS number of N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide is 519004-84-3.
What is the molecular formula of N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide?
The molecular formula of N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide is C17H27N3O.
What is the molecular weight of N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide?
The molecular weight of N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide is 289.22 g/mol.
Where can I buy N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide?
You can request a quote for N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,5-dimethylphenyl)-3-(4-ethylpiperazin-1-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.