![N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea structure](/static/products/4391/439121-12-7.webp)
N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea
TL;DR: N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea (CAS 439121-12-7) is a chemical compound with molecular formula C16H14N4OS and molecular weight 310.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)-3-(4-thiophen-2-ylpyrimidin-2-yl)urea
Also Known As: N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea, 1-(4-methylphenyl)-3-[4-(thiophen-2-yl)pyrimidin-2-yl]urea, 1-(4-methylphenyl)-3-(4-thiophen-2-ylpyrimidin-2-yl)urea, 9R-0624, 1-(p-tolyl)-3-[4-(2-thienyl)pyrimidin-2-yl]urea
| Molecular Formula | C16H14N4OS |
|---|---|
| Molecular Weight | 310.09 g/mol |
| LogP | 4.15752 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.08884 |
| Heavy Atoms | 22 |
| Complexity | 769.1046 |
Chemical Identifiers
| CAS Number | 439121-12-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)NC2=NC=CC(=N2)C3=CC=CS3 |
Product Overview
N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea (CAS 439121-12-7), with molecular formula C16H14N4OS and molecular weight 310.09 g/mol. IUPAC: 1-(4-methylphenyl)-3-(4-thiophen-2-ylpyrimidin-2-yl)urea.
Chemical Property Profile of N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea
Property Insights of N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea
The XLogP value of 4.15752 indicates that N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.91 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea. Following Lipinski's Rule of Five, N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]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 N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea?
The CAS number of N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea is 439121-12-7.
What is the molecular formula of N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea?
The molecular formula of N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea is C16H14N4OS.
What is the molecular weight of N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea?
The molecular weight of N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea is 310.09 g/mol.
Where can I buy N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea?
You can request a quote for N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methylphenyl)-N'-[4-(2-thienyl)-2-pyrimidinyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.