5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide
TL;DR: 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide (CAS 332116-32-2) is a chemical compound with molecular formula C20H17N5O4 and molecular weight 391.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide
Also Known As: BAS 01128719, 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide, 5-nitro-N,N'-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide, 5-Nitro-N,N'-bis-pyridin-3-ylmethyl-isophthalamide, 5-nitro-N1,N3-bis(pyridin-3-ylmethyl)isophthalamide
| Molecular Formula | C20H17N5O4 |
|---|---|
| Molecular Weight | 391.13 g/mol |
| LogP | 2.2448 |
| Topological Polar Surface Area | 127.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 391.12805 |
| Heavy Atoms | 29 |
| Complexity | 951.8063 |
Chemical Identifiers
| CAS Number | 332116-32-2 |
|---|---|
| SMILES | C1=CC(=CN=C1)CNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NCC3=CN=CC=C3 |
Product Overview
5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide (CAS 332116-32-2), with molecular formula C20H17N5O4 and molecular weight 391.13 g/mol. IUPAC: 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide.
Chemical Property Profile of 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide
Property Insights of 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide
The XLogP value of 2.2448 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide. The TPSA of 127.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide. Following Lipinski's Rule of Five, 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide has 2 hydrogen bond donor(s) and 6 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 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide?
The CAS number of 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide is 332116-32-2.
What is the molecular formula of 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide?
The molecular formula of 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide is C20H17N5O4.
What is the molecular weight of 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide?
The molecular weight of 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide is 391.13 g/mol.
Where can I buy 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide?
You can request a quote for 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-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 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-nitro-1-N,3-N-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.