N,N-Diisopropyl-3,5-dinitrobenzamide
TL;DR: N,N-Diisopropyl-3,5-dinitrobenzamide (CAS 14402-06-3) is a chemical compound with molecular formula C13H17N3O5 and molecular weight 295.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dinitro-N,N-di(propan-2-yl)benzamide
Also Known As: N,N-Diisopropyl-3,5-dinitrobenzamide, 3,5-Dinitro-N,N-bis(propan-2-yl)benzamide, N,N-Diisopropyl-3,5-dinitro-benzamide, BAS 00399144, 3,5-dinitro-N,N-di(propan-2-yl)benzamide
| Molecular Formula | C13H17N3O5 |
|---|---|
| Molecular Weight | 295.12 g/mol |
| LogP | 2.762 |
| Topological Polar Surface Area | 106.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 295.11682 |
| Heavy Atoms | 21 |
| Complexity | 542.9195 |
Chemical Identifiers
| CAS Number | 14402-06-3 |
|---|---|
| SMILES | CC(C)N(C(C)C)C(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N,N-Diisopropyl-3,5-dinitrobenzamide (CAS 14402-06-3), with molecular formula C13H17N3O5 and molecular weight 295.12 g/mol. IUPAC: 3,5-dinitro-N,N-di(propan-2-yl)benzamide.
Chemical Property Profile of N,N-Diisopropyl-3,5-dinitrobenzamide
Property Insights of N,N-Diisopropyl-3,5-dinitrobenzamide
The XLogP value of 2.762 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Diisopropyl-3,5-dinitrobenzamide. The TPSA of 106.59 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Diisopropyl-3,5-dinitrobenzamide. Following Lipinski's Rule of Five, N,N-Diisopropyl-3,5-dinitrobenzamide has 0 hydrogen bond donor(s) and 5 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,N-Diisopropyl-3,5-dinitrobenzamide?
The CAS number of N,N-Diisopropyl-3,5-dinitrobenzamide is 14402-06-3.
What is the molecular formula of N,N-Diisopropyl-3,5-dinitrobenzamide?
The molecular formula of N,N-Diisopropyl-3,5-dinitrobenzamide is C13H17N3O5.
What is the molecular weight of N,N-Diisopropyl-3,5-dinitrobenzamide?
The molecular weight of N,N-Diisopropyl-3,5-dinitrobenzamide is 295.12 g/mol.
Where can I buy N,N-Diisopropyl-3,5-dinitrobenzamide?
You can request a quote for N,N-Diisopropyl-3,5-dinitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Diisopropyl-3,5-dinitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diisopropyl-3,5-dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.