1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide
TL;DR: 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide (CAS 332116-29-7) is a chemical compound with molecular formula C26H27N3O4 and molecular weight 445.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide
Also Known As: BAS 01128695, N,N'-Diethyl-5-nitro-N,N'-di-o-tolyl-isophthalamide, 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide, N1,N3-Diethyl-5-nitro-N1,N3-di-o-tolylisophthalamide, N,N'-diethyl-N,N'-bis(2-methylphenyl)-5-nitroisophthalamide
| Molecular Formula | C26H27N3O4 |
|---|---|
| Molecular Weight | 445.20 g/mol |
| LogP | 5.54504 |
| Topological Polar Surface Area | 83.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 445.20016 |
| Heavy Atoms | 33 |
| Complexity | 1121.8964 |
Chemical Identifiers
| CAS Number | 332116-29-7 |
|---|---|
| SMILES | CCN(C1=CC=CC=C1C)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)N(CC)C3=CC=CC=C3C |
Product Overview
1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide (CAS 332116-29-7), with molecular formula C26H27N3O4 and molecular weight 445.20 g/mol. IUPAC: 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide.
Chemical Property Profile of 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide
Property Insights of 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide
The XLogP value of 5.54504 indicates that 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide. Following Lipinski's Rule of Five, 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide?
The CAS number of 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide is 332116-29-7.
What is the molecular formula of 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide?
The molecular formula of 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide is C26H27N3O4.
What is the molecular weight of 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide?
The molecular weight of 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide is 445.20 g/mol.
Where can I buy 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide?
You can request a quote for 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-N,3-N-diethyl-1-N,3-N-bis(2-methylphenyl)-5-nitrobenzene-1,3-dicarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.