![1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea structure](/static/products/5886/588682-66-0.webp)
1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea
TL;DR: 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea (CAS 588682-66-0) is a chemical compound with molecular formula C12H15ClFN3O2S and molecular weight 319.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(2-chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea
Also Known As: 1-[2-(2-chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea, 1-[2-(2-chloro-4-fluoro-phenoxy)propanoylamino]-3-ethyl-thiourea, 2-(2-chloro-4-fluorophenoxy)-N-{[(ethylamino)thioxomethyl]amino}propanamide, 2-[2-(2-chloro-4-fluorophenoxy)propanoyl]-N-ethylhydrazinecarbothioamide
| Molecular Formula | C12H15ClFN3O2S |
|---|---|
| Molecular Weight | 319.06 g/mol |
| LogP | 1.7616 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.05576 |
| Heavy Atoms | 20 |
| Complexity | 501.59082 |
Chemical Identifiers
| CAS Number | 588682-66-0 |
|---|---|
| SMILES | CCNC(=S)NNC(=O)C(C)OC1=C(C=C(C=C1)F)Cl |
Product Overview
1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea (CAS 588682-66-0), with molecular formula C12H15ClFN3O2S and molecular weight 319.06 g/mol. IUPAC: 1-[2-(2-chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea.
Chemical Property Profile of 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea
Property Insights of 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea
The XLogP value of 1.7616 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea. The TPSA of 62.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea. Following Lipinski's Rule of Five, 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea 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)propanoylamino]-3-ethylthiourea?
The CAS number of 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea is 588682-66-0.
What is the molecular formula of 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea?
The molecular formula of 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea is C12H15ClFN3O2S.
What is the molecular weight of 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea?
The molecular weight of 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea is 319.06 g/mol.
Where can I buy 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea?
You can request a quote for 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea 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)propanoylamino]-3-ethylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(2-Chloro-4-fluorophenoxy)propanoylamino]-3-ethylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.