1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide
TL;DR: 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide (CAS 337502-05-3) is a chemical compound with molecular formula C23H28N4O5 and molecular weight 440.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide
Also Known As: BAS 01355280, BIM-0007221.P001, 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide, N1,N3-Diisobutyl-N5-(4-nitrophenyl)benzene-1,3,5-tricarboxamide, {3,5-bis[N-(2-methylpropyl)carbamoyl]phenyl}-N-(4-nitrophenyl)carboxamide
| Molecular Formula | C23H28N4O5 |
|---|---|
| Molecular Weight | 440.21 g/mol |
| LogP | 3.6187 |
| Topological Polar Surface Area | 130.44 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 440.20596 |
| Heavy Atoms | 32 |
| Complexity | 957.69635 |
Chemical Identifiers
| CAS Number | 337502-05-3 |
|---|---|
| SMILES | CC(C)CNC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NCC(C)C |
Product Overview
1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide (CAS 337502-05-3), with molecular formula C23H28N4O5 and molecular weight 440.21 g/mol. IUPAC: 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide.
Chemical Property Profile of 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide
Property Insights of 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide
The XLogP value of 3.6187 indicates that 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide. Following Lipinski's Rule of Five, 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide has 3 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 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide?
The CAS number of 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide is 337502-05-3.
What is the molecular formula of 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide?
The molecular formula of 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide is C23H28N4O5.
What is the molecular weight of 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide?
The molecular weight of 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide is 440.21 g/mol.
Where can I buy 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide?
You can request a quote for 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-N,5-N-bis(2-methylpropyl)-3-N-(4-nitrophenyl)benzene-1,3,5-tricarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.