1-(2-Chloropyridin-3-yl)-3-methylthiourea
TL;DR: 1-(2-Chloropyridin-3-yl)-3-methylthiourea (CAS 452325-37-0) is a chemical compound with molecular formula C7H8ClN3S and molecular weight 201.01274 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-chloro-3-pyridinyl)-3-methylthiourea
Also Known As: 1-(2-chloropyridin-3-yl)-3-methylthiourea, N-(2-chloro-3-pyridinyl)-N'-methylthiourea, AI-204/31686046, [(2-chloro(3-pyridyl))amino](methylamino)methane-1-thione
Technical Specifications
| Molecular Formula | C7H8ClN3S |
| Molecular Weight | 201.01274 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 69.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.01274 Da |
| Heavy Atoms | 12 |
| Complexity | 165.0 |
| SMILES | CNC(=S)NC1=C(N=CC=C1)Cl |
| InChIKey | LWXBBWSTJKOFGH-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2-Chloropyridin-3-yl)-3-methylthiourea
Property Insights of 1-(2-Chloropyridin-3-yl)-3-methylthiourea
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloropyridin-3-yl)-3-methylthiourea. The TPSA of 69.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Chloropyridin-3-yl)-3-methylthiourea. Following Lipinski's Rule of Five, 1-(2-Chloropyridin-3-yl)-3-methylthiourea 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
What is the CAS number of 1-(2-Chloropyridin-3-yl)-3-methylthiourea?
The CAS number of 1-(2-Chloropyridin-3-yl)-3-methylthiourea is 452325-37-0.
What is the molecular formula of 1-(2-Chloropyridin-3-yl)-3-methylthiourea?
The molecular formula of 1-(2-Chloropyridin-3-yl)-3-methylthiourea is C7H8ClN3S.
What is the molecular weight of 1-(2-Chloropyridin-3-yl)-3-methylthiourea?
The molecular weight of 1-(2-Chloropyridin-3-yl)-3-methylthiourea is 201.01274 g/mol.
Where can I buy 1-(2-Chloropyridin-3-yl)-3-methylthiourea?
You can request a quote for 1-(2-Chloropyridin-3-yl)-3-methylthiourea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2-Chloropyridin-3-yl)-3-methylthiourea?
Yes, CoreyChem provides custom synthesis services for 1-(2-Chloropyridin-3-yl)-3-methylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.