(4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone
TL;DR: (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone (CAS 694472-64-5) is a chemical compound with molecular formula C19H21N3O3 and molecular weight 339.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2,4-dimethylphenyl)piperazin-1-yl]-(3-nitrophenyl)methanone
Also Known As: (4-(2,4-dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone, 1-(2,4-DIMETHYLPHENYL)-4-(3-NITROBENZOYL)PIPERAZINE, F1406-0140, [4-(2,4-dimethylphenyl)piperazin-1-yl]-(3-nitrophenyl)methanone, (m-nitrophenyl)[4-(2,4-xylyl)-1-piperazinyl]methanone
| Molecular Formula | C19H21N3O3 |
|---|---|
| Molecular Weight | 339.16 g/mol |
| LogP | 3.17404 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.1583 |
| Heavy Atoms | 25 |
| Complexity | 811.31165 |
Chemical Identifiers
| CAS Number | 694472-64-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C |
Product Overview
(4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone (CAS 694472-64-5), with molecular formula C19H21N3O3 and molecular weight 339.16 g/mol. IUPAC: [4-(2,4-dimethylphenyl)piperazin-1-yl]-(3-nitrophenyl)methanone.
Chemical Property Profile of (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone
Property Insights of (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone
The XLogP value of 3.17404 indicates that (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone. Following Lipinski's Rule of Five, (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone has 0 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 (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone?
The CAS number of (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone is 694472-64-5.
What is the molecular formula of (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone?
The molecular formula of (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone is C19H21N3O3.
What is the molecular weight of (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone?
The molecular weight of (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone is 339.16 g/mol.
Where can I buy (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone?
You can request a quote for (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-(2,4-Dimethylphenyl)piperazin-1-yl)(3-nitrophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.