2-chloro-4-nitro-N-pentan-3-ylbenzamide
TL;DR: 2-chloro-4-nitro-N-pentan-3-ylbenzamide (CAS 349617-66-9) 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.
2-chloro-4-nitro-N-pentan-3-ylbenzamide
Also Known As: 2-chloro-4-nitro-N-pentan-3-ylbenzamide, 2-chloro-4-nitro-N-(pentan-3-yl)benzamide, AB00111697-01, (2-chloro-4-nitrophenyl)-N-(ethylpropyl)carboxamide, 2-CHLORO-N-(1-ETHYLPROPYL)-4-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 | 458.63577 |
Chemical Identifiers
| CAS Number | 349617-66-9 |
|---|---|
| SMILES | CCC(CC)NC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl |
Product Overview
2-chloro-4-nitro-N-pentan-3-ylbenzamide (CAS 349617-66-9), with molecular formula C12H15ClN2O3 and molecular weight 270.08 g/mol. IUPAC: 2-chloro-4-nitro-N-pentan-3-ylbenzamide.
Chemical Property Profile of 2-chloro-4-nitro-N-pentan-3-ylbenzamide
Property Insights of 2-chloro-4-nitro-N-pentan-3-ylbenzamide
The XLogP value of 3.1666 indicates that 2-chloro-4-nitro-N-pentan-3-ylbenzamide 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 2-chloro-4-nitro-N-pentan-3-ylbenzamide. Following Lipinski's Rule of Five, 2-chloro-4-nitro-N-pentan-3-ylbenzamide 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 2-chloro-4-nitro-N-pentan-3-ylbenzamide?
The CAS number of 2-chloro-4-nitro-N-pentan-3-ylbenzamide is 349617-66-9.
What is the molecular formula of 2-chloro-4-nitro-N-pentan-3-ylbenzamide?
The molecular formula of 2-chloro-4-nitro-N-pentan-3-ylbenzamide is C12H15ClN2O3.
What is the molecular weight of 2-chloro-4-nitro-N-pentan-3-ylbenzamide?
The molecular weight of 2-chloro-4-nitro-N-pentan-3-ylbenzamide is 270.08 g/mol.
Where can I buy 2-chloro-4-nitro-N-pentan-3-ylbenzamide?
You can request a quote for 2-chloro-4-nitro-N-pentan-3-ylbenzamide 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-nitro-N-pentan-3-ylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-4-nitro-N-pentan-3-ylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.