1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea
TL;DR: 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea (CAS 669751-71-7) is a chemical compound with molecular formula C13H13FN4O2S and molecular weight 308.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,6-dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea
Also Known As: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea, [(4,6-dimethoxypyrimidin-2-yl)amino][(4-fluorophenyl)amino]methane-1-thione
| Molecular Formula | C13H13FN4O2S |
|---|---|
| Molecular Weight | 308.07 g/mol |
| LogP | 2.4418 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.0743 |
| Heavy Atoms | 21 |
| Complexity | 614.3184 |
Chemical Identifiers
| CAS Number | 669751-71-7 |
|---|---|
| SMILES | COC1=CC(=NC(=N1)NC(=S)NC2=CC=C(C=C2)F)OC |
Product Overview
1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea (CAS 669751-71-7), with molecular formula C13H13FN4O2S and molecular weight 308.07 g/mol. IUPAC: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea.
Chemical Property Profile of 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea
Property Insights of 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea
The XLogP value of 2.4418 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea. Following Lipinski's Rule of Five, 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea has 2 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-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea?
The CAS number of 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea is 669751-71-7.
What is the molecular formula of 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea?
The molecular formula of 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea is C13H13FN4O2S.
What is the molecular weight of 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea?
The molecular weight of 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea is 308.07 g/mol.
Where can I buy 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea?
You can request a quote for 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,6-Dimethoxypyrimidin-2-yl)-3-(4-fluorophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.