(4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone
TL;DR: (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone (CAS 500584-95-2) is a chemical compound with molecular formula C18H18ClN3O3 and molecular weight 359.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(3-chloro-4-methylphenyl)piperazin-1-yl]-(4-nitrophenyl)methanone
Also Known As: 1-(3-CHLORO-4-METHYLPHENYL)-4-(4-NITROBENZOYL)PIPERAZINE, (4-(3-chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone, F1406-0178, [4-(3-chloro-4-methylphenyl)piperazin-1-yl]-(4-nitrophenyl)methanone, 4-(3-chloro-4-methylphenyl)piperazinyl 4-nitrophenyl ketone
| Molecular Formula | C18H18ClN3O3 |
|---|---|
| Molecular Weight | 359.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.10367 |
| Heavy Atoms | 25 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 500584-95-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl |
| InChIKey | UPKKCAWPYYBWQL-UHFFFAOYSA-N |
Product Overview
(4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone (CAS 500584-95-2), with molecular formula C18H18ClN3O3 and molecular weight 359.10 g/mol. IUPAC: [4-(3-chloro-4-methylphenyl)piperazin-1-yl]-(4-nitrophenyl)methanone.
Chemical Property Profile of (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone
Property Insights of (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone
The XLogP value of 3.8 indicates that (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone. Following Lipinski's Rule of Five, (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-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-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone?
The CAS number of (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone is 500584-95-2.
What is the molecular formula of (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone?
The molecular formula of (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone is C18H18ClN3O3.
What is the molecular weight of (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone?
The molecular weight of (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone is 359.10 g/mol.
Where can I buy (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone?
You can request a quote for (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-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-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-(3-Chloro-4-methylphenyl)piperazin-1-yl)(4-nitrophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.