N,N'-dicyclopropyl-5-nitroisophthalamide
TL;DR: N,N'-dicyclopropyl-5-nitroisophthalamide (CAS 330646-55-4) is a chemical compound with molecular formula C14H15N3O4 and molecular weight 289.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,3-N-dicyclopropyl-5-nitrobenzene-1,3-dicarboxamide
Also Known As: N,N'-dicyclopropyl-5-nitroisophthalamide, N1,N3-Dicyclopropyl-5-nitroisophthalamide, N,N'-Dicyclopropyl-5-nitro-isophthalamide, 1-N,3-N-dicyclopropyl-5-nitrobenzene-1,3-dicarboxamide, N1,N3-DICYCLOPROPYL-5-NITROBENZENE-1,3-DICARBOXAMIDE
| Molecular Formula | C14H15N3O4 |
|---|---|
| Molecular Weight | 289.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.10626 |
| Heavy Atoms | 21 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 330646-55-4 |
|---|---|
| SMILES | C1CC1NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NC3CC3 |
| InChIKey | CDWAYSLDUNOSGY-UHFFFAOYSA-N |
Product Overview
N,N'-dicyclopropyl-5-nitroisophthalamide (CAS 330646-55-4), with molecular formula C14H15N3O4 and molecular weight 289.11 g/mol. IUPAC: 1-N,3-N-dicyclopropyl-5-nitrobenzene-1,3-dicarboxamide.
Chemical Property Profile of N,N'-dicyclopropyl-5-nitroisophthalamide
Property Insights of N,N'-dicyclopropyl-5-nitroisophthalamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-dicyclopropyl-5-nitroisophthalamide. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-dicyclopropyl-5-nitroisophthalamide. Following Lipinski's Rule of Five, N,N'-dicyclopropyl-5-nitroisophthalamide has 2 hydrogen bond donor(s) and 4 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'-dicyclopropyl-5-nitroisophthalamide?
The CAS number of N,N'-dicyclopropyl-5-nitroisophthalamide is 330646-55-4.
What is the molecular formula of N,N'-dicyclopropyl-5-nitroisophthalamide?
The molecular formula of N,N'-dicyclopropyl-5-nitroisophthalamide is C14H15N3O4.
What is the molecular weight of N,N'-dicyclopropyl-5-nitroisophthalamide?
The molecular weight of N,N'-dicyclopropyl-5-nitroisophthalamide is 289.11 g/mol.
Where can I buy N,N'-dicyclopropyl-5-nitroisophthalamide?
You can request a quote for N,N'-dicyclopropyl-5-nitroisophthalamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-dicyclopropyl-5-nitroisophthalamide?
Yes, KEHONG BIO provides custom synthesis services for N,N'-dicyclopropyl-5-nitroisophthalamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.