1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea
TL;DR: 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea (CAS 18233-39-1) is a chemical compound with molecular formula C12H13Cl2N3O2S and molecular weight 333.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(2,4-dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea
Also Known As: 1-[[2-(2,4-dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea, 2-(2,4-dichlorophenoxy)-N-[(E)-N-(prop-2-en-1-yl)-(C-sulfanylcarbonimidoyl)amino]acetamide, 2-[(2,4-dichlorophenoxy)acetyl]-N-(prop-2-en-1-yl)hydrazinecarbothioamide, N-allyl-2-[(2,4-dichlorophenoxy)acetyl]hydrazinecarbothioamide, (E)-N-allyl-N'-(2-(2,4-dichlorophenoxy)acetyl)carbamohydrazonothioic acid
| Molecular Formula | C12H13Cl2N3O2S |
|---|---|
| Molecular Weight | 333.01 g/mol |
| LogP | 2.0535 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.01056 |
| Heavy Atoms | 20 |
| Complexity | 511.47583 |
Chemical Identifiers
| CAS Number | 18233-39-1 |
|---|---|
| SMILES | C=CCNC(=S)NNC(=O)COC1=C(C=C(C=C1)Cl)Cl |
Product Overview
1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea (CAS 18233-39-1), with molecular formula C12H13Cl2N3O2S and molecular weight 333.01 g/mol. IUPAC: 1-[[2-(2,4-dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea.
Chemical Property Profile of 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea
Property Insights of 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea
The XLogP value of 2.0535 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea. The TPSA of 62.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea. Following Lipinski's Rule of Five, 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea 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-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea?
The CAS number of 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea is 18233-39-1.
What is the molecular formula of 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea?
The molecular formula of 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea is C12H13Cl2N3O2S.
What is the molecular weight of 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea?
The molecular weight of 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea is 333.01 g/mol.
Where can I buy 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea?
You can request a quote for 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-(2,4-Dichlorophenoxy)acetyl]amino]-3-prop-2-enylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.