3-(5-Nitropyridin-2-yl)-1-phenylurea
TL;DR: 3-(5-Nitropyridin-2-yl)-1-phenylurea (CAS 100137-20-0) is a chemical compound with molecular formula C12H10N4O3 and molecular weight 258.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-nitro-2-pyridinyl)-3-phenylurea
Also Known As: 3-(5-nitropyridin-2-yl)-1-phenylurea, 1-(5-nitropyridin-2-yl)-3-phenylurea, 1-(5-nitro-2-pyridyl)-3-phenyl-urea, Urea, N-(5-nitro-2-pyridinyl)-N'-phenyl-, 1-(5-Nitropyridin-2-yl)-3-phenyl urea
| Molecular Formula | C12H10N4O3 |
|---|---|
| Molecular Weight | 258.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 99.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 258.0753 |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 100137-20-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NC2=NC=C(C=C2)[N+](=O)[O-] |
| InChIKey | JKZXNSOYVTUBLO-UHFFFAOYSA-N |
Product Overview
3-(5-Nitropyridin-2-yl)-1-phenylurea (CAS 100137-20-0), with molecular formula C12H10N4O3 and molecular weight 258.08 g/mol. IUPAC: 1-(5-nitro-2-pyridinyl)-3-phenylurea.
Chemical Property Profile of 3-(5-Nitropyridin-2-yl)-1-phenylurea
Property Insights of 3-(5-Nitropyridin-2-yl)-1-phenylurea
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Nitropyridin-2-yl)-1-phenylurea. The TPSA of 99.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Nitropyridin-2-yl)-1-phenylurea. Following Lipinski's Rule of Five, 3-(5-Nitropyridin-2-yl)-1-phenylurea 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 3-(5-Nitropyridin-2-yl)-1-phenylurea?
The CAS number of 3-(5-Nitropyridin-2-yl)-1-phenylurea is 100137-20-0.
What is the molecular formula of 3-(5-Nitropyridin-2-yl)-1-phenylurea?
The molecular formula of 3-(5-Nitropyridin-2-yl)-1-phenylurea is C12H10N4O3.
What is the molecular weight of 3-(5-Nitropyridin-2-yl)-1-phenylurea?
The molecular weight of 3-(5-Nitropyridin-2-yl)-1-phenylurea is 258.08 g/mol.
Where can I buy 3-(5-Nitropyridin-2-yl)-1-phenylurea?
You can request a quote for 3-(5-Nitropyridin-2-yl)-1-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Nitropyridin-2-yl)-1-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Nitropyridin-2-yl)-1-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.