![(4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone structure](/static/products/4304/430456-31-8.webp)
(4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone
TL;DR: (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone (CAS 430456-31-8) is a chemical compound with molecular formula C18H19N3O3 and molecular weight 325.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone
Also Known As: AB00112675-01, 1-(4-methylbenzoyl)-4-(2-nitrophenyl)piperazine, (4-methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone, (4-methylphenyl)[4-(2-nitrophenyl)piperazin-1-yl]methanone
| Molecular Formula | C18H19N3O3 |
|---|---|
| Molecular Weight | 325.14 g/mol |
| LogP | 2.86562 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.14264 |
| Heavy Atoms | 24 |
| Complexity | 750.35925 |
Chemical Identifiers
| CAS Number | 430456-31-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
(4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone (CAS 430456-31-8), with molecular formula C18H19N3O3 and molecular weight 325.14 g/mol. IUPAC: (4-methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone.
Chemical Property Profile of (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone
Property Insights of (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone
The XLogP value of 2.86562 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone. Following Lipinski's Rule of Five, (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]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-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone?
The CAS number of (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone is 430456-31-8.
What is the molecular formula of (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone?
The molecular formula of (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone is C18H19N3O3.
What is the molecular weight of (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone?
The molecular weight of (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone is 325.14 g/mol.
Where can I buy (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone?
You can request a quote for (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Methylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.