N-(Sec-butyl)-2-chloro-4-nitrobenzamide
TL;DR: N-(Sec-butyl)-2-chloro-4-nitrobenzamide (CAS 311792-74-2) is a chemical compound with molecular formula C11H13ClN2O3 and molecular weight 256.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butan-2-yl-2-chloro-4-nitrobenzamide
Also Known As: N-(butan-2-yl)-2-chloro-4-nitrobenzamide, N-butan-2-yl-2-chloro-4-nitrobenzamide, N-(SEC-BUTYL)-2-CHLORO-4-NITROBENZAMIDE, 2-CHLORO-4-NITRO-N-(SEC-BUTYL)BENZAMIDE, AB00081957-01
| Molecular Formula | C11H13ClN2O3 |
|---|---|
| Molecular Weight | 256.06 g/mol |
| LogP | 2.7765 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.06146 |
| Heavy Atoms | 17 |
| Complexity | 448.3427 |
Chemical Identifiers
| CAS Number | 311792-74-2 |
|---|---|
| SMILES | CCC(C)NC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl |
Product Overview
N-(Sec-butyl)-2-chloro-4-nitrobenzamide (CAS 311792-74-2), with molecular formula C11H13ClN2O3 and molecular weight 256.06 g/mol. IUPAC: N-butan-2-yl-2-chloro-4-nitrobenzamide.
Chemical Property Profile of N-(Sec-butyl)-2-chloro-4-nitrobenzamide
Property Insights of N-(Sec-butyl)-2-chloro-4-nitrobenzamide
The XLogP value of 2.7765 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(Sec-butyl)-2-chloro-4-nitrobenzamide. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(Sec-butyl)-2-chloro-4-nitrobenzamide. Following Lipinski's Rule of Five, N-(Sec-butyl)-2-chloro-4-nitrobenzamide 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 N-(Sec-butyl)-2-chloro-4-nitrobenzamide?
The CAS number of N-(Sec-butyl)-2-chloro-4-nitrobenzamide is 311792-74-2.
What is the molecular formula of N-(Sec-butyl)-2-chloro-4-nitrobenzamide?
The molecular formula of N-(Sec-butyl)-2-chloro-4-nitrobenzamide is C11H13ClN2O3.
What is the molecular weight of N-(Sec-butyl)-2-chloro-4-nitrobenzamide?
The molecular weight of N-(Sec-butyl)-2-chloro-4-nitrobenzamide is 256.06 g/mol.
Where can I buy N-(Sec-butyl)-2-chloro-4-nitrobenzamide?
You can request a quote for N-(Sec-butyl)-2-chloro-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Sec-butyl)-2-chloro-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(Sec-butyl)-2-chloro-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.