![1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea structure](/static/products/7019/701946-19-2.webp)
1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea
TL;DR: 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea (CAS 701946-19-2) is a chemical compound with molecular formula C10H11ClFN3O2S and molecular weight 291.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(2-chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea
Also Known As: 1-[[2-(2-chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea, 2-[(2-chloro-4-fluorophenoxy)acetyl]-N-methylhydrazinecarbothioamide, 2-(2-chloro-4-fluorophenoxy)-N-{[(methylamino)thioxomethyl]amino}acetamide
| Molecular Formula | C10H11ClFN3O2S |
|---|---|
| Molecular Weight | 291.02 g/mol |
| LogP | 0.983 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.02444 |
| Heavy Atoms | 18 |
| Complexity | 458.74896 |
Chemical Identifiers
| CAS Number | 701946-19-2 |
|---|---|
| SMILES | CNC(=S)NNC(=O)COC1=C(C=C(C=C1)F)Cl |
Product Overview
1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea (CAS 701946-19-2), with molecular formula C10H11ClFN3O2S and molecular weight 291.02 g/mol. IUPAC: 1-[[2-(2-chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea.
Chemical Property Profile of 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea
Property Insights of 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea
The XLogP value of 0.983 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea. The TPSA of 62.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea. Following Lipinski's Rule of Five, 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea has 3 hydrogen bond donor(s) and 3 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-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea?
The CAS number of 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea is 701946-19-2.
What is the molecular formula of 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea?
The molecular formula of 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea is C10H11ClFN3O2S.
What is the molecular weight of 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea?
The molecular weight of 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea is 291.02 g/mol.
Where can I buy 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea?
You can request a quote for 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-(2-Chloro-4-fluorophenoxy)acetyl]amino]-3-methylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.