![1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea structure](/static/products/1394/13949-43-4.webp)
1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea
TL;DR: 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea (CAS 13949-43-4) is a chemical compound with molecular formula C13H18ClN3O2S and molecular weight 315.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea
Also Known As: 1-[2-(4-chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea, 1-[2-(4-chloro-2-methyl-phenoxy)propanoylamino]-3-ethyl-thiourea, 2-(4-chloro-2-methylphenoxy)-N-{[(ethylamino)thioxomethyl]amino}propanamide, 2-[2-(4-chloro-2-methylphenoxy)propanoyl]-N-ethylhydrazinecarbothioamide
| Molecular Formula | C13H18ClN3O2S |
|---|---|
| Molecular Weight | 315.08 g/mol |
| LogP | 1.93092 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.0808 |
| Heavy Atoms | 20 |
| Complexity | 496.50467 |
Chemical Identifiers
| CAS Number | 13949-43-4 |
|---|---|
| SMILES | CCNC(=S)NNC(=O)C(C)OC1=C(C=C(C=C1)Cl)C |
Product Overview
1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea (CAS 13949-43-4), with molecular formula C13H18ClN3O2S and molecular weight 315.08 g/mol. IUPAC: 1-[2-(4-chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea.
Chemical Property Profile of 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea
Property Insights of 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea
The XLogP value of 1.93092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea. The TPSA of 62.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea. Following Lipinski's Rule of Five, 1-[2-(4-Chloro-2-methylphenoxy)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-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea?
The CAS number of 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea is 13949-43-4.
What is the molecular formula of 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea?
The molecular formula of 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea is C13H18ClN3O2S.
What is the molecular weight of 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea?
The molecular weight of 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea is 315.08 g/mol.
Where can I buy 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea?
You can request a quote for 1-[2-(4-Chloro-2-methylphenoxy)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-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(4-Chloro-2-methylphenoxy)propanoylamino]-3-ethylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.