(4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone
TL;DR: (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone (CAS 333346-80-8) is a chemical compound with molecular formula C13H15ClN2O3 and molecular weight 282.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone
Also Known As: BAS 00783399, 1-{4-chloro-2-nitrobenzoyl}-4-methylpiperidine, 4-chloro-2-nitrophenyl 4-methylpiperidyl ketone, (4-chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone, (4-chloro-2-nitrophenyl)(4-methylpiperidin-1-yl)methanone
| Molecular Formula | C13H15ClN2O3 |
|---|---|
| Molecular Weight | 282.08 g/mol |
| LogP | 3.1203 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.07712 |
| Heavy Atoms | 19 |
| Complexity | 510.60983 |
Chemical Identifiers
| CAS Number | 333346-80-8 |
|---|---|
| SMILES | CC1CCN(CC1)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
(4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone (CAS 333346-80-8), with molecular formula C13H15ClN2O3 and molecular weight 282.08 g/mol. IUPAC: (4-chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone.
Chemical Property Profile of (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone
Property Insights of (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone
The XLogP value of 3.1203 indicates that (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone. Following Lipinski's Rule of Five, (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone has 0 hydrogen bond donor(s) and 3 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-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone?
The CAS number of (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone is 333346-80-8.
What is the molecular formula of (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone?
The molecular formula of (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone is C13H15ClN2O3.
What is the molecular weight of (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone?
The molecular weight of (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone is 282.08 g/mol.
Where can I buy (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone?
You can request a quote for (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-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-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Chloro-2-nitrophenyl)-(4-methylpiperidin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.