2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide
TL;DR: 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide (CAS 302576-23-4) is a chemical compound with molecular formula C15H21ClN2O3 and molecular weight 312.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide
Also Known As: 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide, N,N-diisobutyl2-chloro-5-nitrobenzamide, 2-chloro-N,N-diisobutyl-5-nitrobenzamide, VU0508976-1, F3095-2552
| Molecular Formula | C15H21ClN2O3 |
|---|---|
| Molecular Weight | 312.12 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.12408 |
| Heavy Atoms | 21 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 302576-23-4 |
|---|---|
| SMILES | CC(C)CN(CC(C)C)C(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl |
| InChIKey | YPGGQCPCKCWIAJ-UHFFFAOYSA-N |
Product Overview
2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide (CAS 302576-23-4), with molecular formula C15H21ClN2O3 and molecular weight 312.12 g/mol. IUPAC: 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide.
Chemical Property Profile of 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide
Property Insights of 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide
The XLogP value of 4.6 indicates that 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide. Following Lipinski's Rule of Five, 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide 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 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide?
The CAS number of 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide is 302576-23-4.
What is the molecular formula of 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide?
The molecular formula of 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide is C15H21ClN2O3.
What is the molecular weight of 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide?
The molecular weight of 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide is 312.12 g/mol.
Where can I buy 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide?
You can request a quote for 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N,N-bis(2-methylpropyl)-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.