N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide
TL;DR: N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide (CAS 428845-54-9) is a chemical compound with molecular formula C21H27N3O and molecular weight 337.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide
Also Known As: N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide, AT-057/43314901, N-(3,4-dimethylphenyl)-3-(4-phenylpiperazinyl)propanamide, N-(3,4-dimethylphenyl)-3-(4-phenyl-1-piperazinyl)propanamide, N~1~-(3,4-DIMETHYLPHENYL)-3-(4-PHENYLPIPERAZINO)PROPANAMIDE
| Molecular Formula | C21H27N3O |
|---|---|
| Molecular Weight | 337.22 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.21542 |
| Heavy Atoms | 25 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 428845-54-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)CCN2CCN(CC2)C3=CC=CC=C3)C |
| InChIKey | MKMCEMPVBAJXIM-UHFFFAOYSA-N |
Product Overview
N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide (CAS 428845-54-9), with molecular formula C21H27N3O and molecular weight 337.22 g/mol. IUPAC: N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide.
Chemical Property Profile of N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide
Property Insights of N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide
The XLogP value of 3.4 indicates that N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.6 Ų, N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-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-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide?
The CAS number of N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide is 428845-54-9.
What is the molecular formula of N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide?
The molecular formula of N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide is C21H27N3O.
What is the molecular weight of N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide?
The molecular weight of N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide is 337.22 g/mol.
Where can I buy N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide?
You can request a quote for N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-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-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.