1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea
TL;DR: 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea (CAS 13208-60-1) is a chemical compound with molecular formula C12H10ClN3O and molecular weight 247.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-pyridin-4-ylurea
Also Known As: 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea, 1-(4-chlorophenyl)-3-pyridin-4-ylurea, 1-(4-Chlorophenyl)-3-(4-pyridyl)urea, Urea, N-(4-chlorophenyl)-N'-4-pyridinyl-, N-(4-Chlorophenyl)-N'-pyridin-4-ylurea
| Molecular Formula | C12H10ClN3O |
|---|---|
| Molecular Weight | 247.05 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.05124 |
| Heavy Atoms | 17 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 13208-60-1 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)NC2=CC=NC=C2)Cl |
| InChIKey | AAVUKLGYVIGYKQ-UHFFFAOYSA-N |
Product Overview
1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea (CAS 13208-60-1), with molecular formula C12H10ClN3O and molecular weight 247.05 g/mol. IUPAC: 1-(4-chlorophenyl)-3-pyridin-4-ylurea.
Chemical Property Profile of 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea
Property Insights of 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea. With a topological polar surface area (TPSA) of 54.0 Ų, 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea has 2 hydrogen bond donor(s) and 2 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-Chlorophenyl)-3-(pyridin-4-yl)urea?
The CAS number of 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea is 13208-60-1.
What is the molecular formula of 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea?
The molecular formula of 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea is C12H10ClN3O.
What is the molecular weight of 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea?
The molecular weight of 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea is 247.05 g/mol.
Where can I buy 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea?
You can request a quote for 1-(4-Chlorophenyl)-3-(pyridin-4-yl)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-Chlorophenyl)-3-(pyridin-4-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-3-(pyridin-4-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.