[4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone
TL;DR: [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone (CAS 311799-47-0) is a chemical compound with molecular formula C16H16ClN3O4 and molecular weight 349.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone
Also Known As: A1712/0072988, [4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone, 1-(2-chloro-4-nitrophenyl)-4-(3-methyl-2-furoyl)piperazine, 1-{2-chloro-4-nitrophenyl}-4-(3-methyl-2-furoyl)piperazine, [4-(2-chloro-4-nitrophenyl)piperazino](3-methyl-2-furyl)methanone
| Molecular Formula | C16H16ClN3O4 |
|---|---|
| Molecular Weight | 349.08 g/mol |
| LogP | 3.11202 |
| Topological Polar Surface Area | 79.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 349.08295 |
| Heavy Atoms | 24 |
| Complexity | 781.37976 |
Chemical Identifiers
| CAS Number | 311799-47-0 |
|---|---|
| SMILES | CC1=C(OC=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl |
Product Overview
[4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone (CAS 311799-47-0), with molecular formula C16H16ClN3O4 and molecular weight 349.08 g/mol. IUPAC: [4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone.
Chemical Property Profile of [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone
Property Insights of [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone
The XLogP value of 3.11202 indicates that [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.83 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone. Following Lipinski's Rule of Five, [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone has 0 hydrogen bond donor(s) and 5 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-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone?
The CAS number of [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone is 311799-47-0.
What is the molecular formula of [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone?
The molecular formula of [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone is C16H16ClN3O4.
What is the molecular weight of [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone?
The molecular weight of [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone is 349.08 g/mol.
Where can I buy [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone?
You can request a quote for [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-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-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [4-(2-Chloro-4-nitrophenyl)piperazin-1-yl]-(3-methylfuran-2-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.