![1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea structure](/static/products/3801/380183-27-7.webp)
1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea
TL;DR: 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea (CAS 380183-27-7) is a chemical compound with molecular formula C13H9F3N4O3 and molecular weight 326.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-nitro-2-pyridinyl)-3-[3-(trifluoromethyl)phenyl]urea
Also Known As: 1-(5-nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea, AI-204/31694043, N-{5-nitro-2-pyridinyl}-N'-[3-(trifluoromethyl)phenyl]urea, N-(5-nitro(2-pyridyl)){[3-(trifluoromethyl)phenyl]amino}carboxamide
| Molecular Formula | C13H9F3N4O3 |
|---|---|
| Molecular Weight | 326.06 g/mol |
| LogP | 3.6526 |
| Topological Polar Surface Area | 97.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.06268 |
| Heavy Atoms | 23 |
| Complexity | 731.98975 |
Chemical Identifiers
| CAS Number | 380183-27-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)NC2=NC=C(C=C2)[N+](=O)[O-])C(F)(F)F |
Product Overview
1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea (CAS 380183-27-7), with molecular formula C13H9F3N4O3 and molecular weight 326.06 g/mol. IUPAC: 1-(5-nitro-2-pyridinyl)-3-[3-(trifluoromethyl)phenyl]urea.
Chemical Property Profile of 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea
Property Insights of 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea
The XLogP value of 3.6526 indicates that 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea. Following Lipinski's Rule of Five, 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea 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 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea?
The CAS number of 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea is 380183-27-7.
What is the molecular formula of 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea?
The molecular formula of 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea is C13H9F3N4O3.
What is the molecular weight of 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea?
The molecular weight of 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea is 326.06 g/mol.
Where can I buy 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea?
You can request a quote for 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Nitropyridin-2-yl)-3-[3-(trifluoromethyl)phenyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.