N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide
TL;DR: N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide (CAS 331979-43-2) is a chemical compound with molecular formula C14H18N4O6 and molecular weight 338.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide
Also Known As: N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide, BAS 00726729, BIM-0025142.P001, 3,5-bisnitro-N-[3-(4-morpholinyl)propyl]benzamide, N-[3-(morpholin-4-yl)propyl]-3,5-dinitrobenzamide
| Molecular Formula | C14H18N4O6 |
|---|---|
| Molecular Weight | 338.12 g/mol |
| LogP | 0.9551 |
| Topological Polar Surface Area | 127.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 338.12262 |
| Heavy Atoms | 24 |
| Complexity | 597.44073 |
Chemical Identifiers
| CAS Number | 331979-43-2 |
|---|---|
| SMILES | C1COCCN1CCCNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide (CAS 331979-43-2), with molecular formula C14H18N4O6 and molecular weight 338.12 g/mol. IUPAC: N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide.
Chemical Property Profile of N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide
Property Insights of N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide
The XLogP value of 0.9551 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide. The TPSA of 127.85 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide. Following Lipinski's Rule of Five, N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide has 1 hydrogen bond donor(s) and 7 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-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide?
The CAS number of N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide is 331979-43-2.
What is the molecular formula of N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide?
The molecular formula of N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide is C14H18N4O6.
What is the molecular weight of N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide?
The molecular weight of N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide is 338.12 g/mol.
Where can I buy N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide?
You can request a quote for N-(3-morpholin-4-ylpropyl)-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-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-morpholin-4-ylpropyl)-3,5-dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.