1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea
TL;DR: 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea (CAS 66037-07-8) is a chemical compound with molecular formula C14H10N4O4 and molecular weight 298.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea
Also Known As: EINECS 266-083-2, 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea, 3-(4-cyanophenyl)-1-(2-hydroxy-4-nitro-phenyl)urea, N-(4-Cyanophenyl)-N'-(2-hydroxy-4-nitrophenyl)urea, Urea, N-(4-cyanophenyl)-N'-(2-hydroxy-4-nitrophenyl)-
| Molecular Formula | C14H10N4O4 |
|---|---|
| Molecular Weight | 298.07 g/mol |
| LogP | 2.81608 |
| Topological Polar Surface Area | 128.29 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.0702 |
| Heavy Atoms | 22 |
| Complexity | 765.4026 |
Chemical Identifiers
| CAS Number | 66037-07-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)NC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O |
Product Overview
1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea (CAS 66037-07-8), with molecular formula C14H10N4O4 and molecular weight 298.07 g/mol. IUPAC: 1-(4-cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea.
Chemical Property Profile of 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea
Property Insights of 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea
The XLogP value of 2.81608 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea. The TPSA of 128.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea. Following Lipinski's Rule of Five, 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea has 3 hydrogen bond donor(s) and 5 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-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea?
The CAS number of 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea is 66037-07-8.
What is the molecular formula of 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea?
The molecular formula of 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea is C14H10N4O4.
What is the molecular weight of 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea?
The molecular weight of 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea is 298.07 g/mol.
Where can I buy 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea?
You can request a quote for 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Cyanophenyl)-3-(2-hydroxy-4-nitrophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.