1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea
TL;DR: 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea (CAS 117745-34-3) is a chemical compound with molecular formula C13H10ClN3O4 and molecular weight 307.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea
Also Known As: 1-(5-chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea, 5-chloro-2-cyclopropanesulfonylpyridine, N-(5-chloro-2-hydroxy-4-nitrophenyl)-N'-phenylurea, Urea, N-(5-chloro-2-hydroxy-4-nitrophenyl)-N'-phenyl-, 3-(5-chloro-2-hydroxy-4-nitrophenyl)-1-phenylurea
| Molecular Formula | C13H10ClN3O4 |
|---|---|
| Molecular Weight | 307.04 g/mol |
| LogP | 3.5978 |
| Topological Polar Surface Area | 104.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.03598 |
| Heavy Atoms | 21 |
| Complexity | 691.3158 |
Chemical Identifiers
| CAS Number | 117745-34-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2O)[N+](=O)[O-])Cl |
Product Overview
1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea (CAS 117745-34-3), with molecular formula C13H10ClN3O4 and molecular weight 307.04 g/mol. IUPAC: 1-(5-chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea.
Chemical Property Profile of 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea
Property Insights of 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea
The XLogP value of 3.5978 indicates that 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea. Following Lipinski's Rule of Five, 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea has 3 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-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea?
The CAS number of 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea is 117745-34-3.
What is the molecular formula of 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea?
The molecular formula of 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea is C13H10ClN3O4.
What is the molecular weight of 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea?
The molecular weight of 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea is 307.04 g/mol.
Where can I buy 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea?
You can request a quote for 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Chloro-2-hydroxy-4-nitrophenyl)-3-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.