(2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone
TL;DR: (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone (CAS 349396-53-8) is a chemical compound with molecular formula C17H16ClN3O3 and molecular weight 345.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone
Also Known As: BIM-0048240.P001, (2-chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone, 2-chloro-4-nitrophenyl 4-phenylpiperazinyl ketone, (2-chloro-4-nitrophenyl)(4-phenylpiperazin-1-yl)methanone, (2-CHLORO-4-NITROPHENYL)(4-PHENYLPIPERAZINO)METHANONE
| Molecular Formula | C17H16ClN3O3 |
|---|---|
| Molecular Weight | 345.09 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 345.088 |
| Heavy Atoms | 24 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 349396-53-8 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=C2)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl |
| InChIKey | ZQQJTNDGUVRWMB-UHFFFAOYSA-N |
Product Overview
(2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone (CAS 349396-53-8), with molecular formula C17H16ClN3O3 and molecular weight 345.09 g/mol. IUPAC: (2-chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone.
Chemical Property Profile of (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone
Property Insights of (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone
The XLogP value of 3.4 indicates that (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)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 (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone. Following Lipinski's Rule of Five, (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-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 (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone?
The CAS number of (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone is 349396-53-8.
What is the molecular formula of (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone?
The molecular formula of (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone is C17H16ClN3O3.
What is the molecular weight of (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone?
The molecular weight of (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone is 345.09 g/mol.
Where can I buy (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone?
You can request a quote for (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-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 (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (2-Chloro-4-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.