4-chloro-3-nitro-N-(pentan-2-yl)benzamide
TL;DR: 4-chloro-3-nitro-N-(pentan-2-yl)benzamide (CAS 349084-75-9) is a chemical compound with molecular formula C12H15ClN2O3 and molecular weight 270.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3-nitro-N-pentan-2-ylbenzamide
Also Known As: 4-chloro-3-nitro-N-(pentan-2-yl)benzamide, 4-chloro-3-nitro-N-pentan-2-ylbenzamide, BIM-0012536.P001, (4-chloro-3-nitrophenyl)-N-(methylbutyl)carboxamide, 4-CHLORO-N-(1-METHYLBUTYL)-3-NITROBENZAMIDE
| Molecular Formula | C12H15ClN2O3 |
|---|---|
| Molecular Weight | 270.08 g/mol |
| LogP | 3.1666 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.07712 |
| Heavy Atoms | 18 |
| Complexity | 462.63577 |
Chemical Identifiers
| CAS Number | 349084-75-9 |
|---|---|
| SMILES | CCCC(C)NC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-] |
Product Overview
4-chloro-3-nitro-N-(pentan-2-yl)benzamide (CAS 349084-75-9), with molecular formula C12H15ClN2O3 and molecular weight 270.08 g/mol. IUPAC: 4-chloro-3-nitro-N-pentan-2-ylbenzamide.
Chemical Property Profile of 4-chloro-3-nitro-N-(pentan-2-yl)benzamide
Property Insights of 4-chloro-3-nitro-N-(pentan-2-yl)benzamide
The XLogP value of 3.1666 indicates that 4-chloro-3-nitro-N-(pentan-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-3-nitro-N-(pentan-2-yl)benzamide. Following Lipinski's Rule of Five, 4-chloro-3-nitro-N-(pentan-2-yl)benzamide has 1 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-3-nitro-N-(pentan-2-yl)benzamide?
The CAS number of 4-chloro-3-nitro-N-(pentan-2-yl)benzamide is 349084-75-9.
What is the molecular formula of 4-chloro-3-nitro-N-(pentan-2-yl)benzamide?
The molecular formula of 4-chloro-3-nitro-N-(pentan-2-yl)benzamide is C12H15ClN2O3.
What is the molecular weight of 4-chloro-3-nitro-N-(pentan-2-yl)benzamide?
The molecular weight of 4-chloro-3-nitro-N-(pentan-2-yl)benzamide is 270.08 g/mol.
Where can I buy 4-chloro-3-nitro-N-(pentan-2-yl)benzamide?
You can request a quote for 4-chloro-3-nitro-N-(pentan-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-3-nitro-N-(pentan-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-3-nitro-N-(pentan-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.