![1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea structure](/static/products/7019/701932-44-7.webp)
1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea
TL;DR: 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea (CAS 701932-44-7) is a chemical compound with molecular formula C13H15Cl2N3OS2 and molecular weight 363.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea
Also Known As: 1-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea, 2-[(3,4-dichlorophenyl)methylthio]-N-{[(prop-2-enylamino)thioxomethyl]amino}ac etamide, 2-{[(3,4-dichlorobenzyl)sulfanyl]acetyl}-N-(prop-2-en-1-yl)hydrazinecarbothioamide
| Molecular Formula | C13H15Cl2N3OS2 |
|---|---|
| Molecular Weight | 363.00 g/mol |
| LogP | 2.9079 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.00336 |
| Heavy Atoms | 21 |
| Complexity | 526.1379 |
Chemical Identifiers
| CAS Number | 701932-44-7 |
|---|---|
| SMILES | C=CCNC(=S)NNC(=O)CSCC1=CC(=C(C=C1)Cl)Cl |
Product Overview
1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea (CAS 701932-44-7), with molecular formula C13H15Cl2N3OS2 and molecular weight 363.00 g/mol. IUPAC: 1-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea.
Chemical Property Profile of 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea
Property Insights of 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea
The XLogP value of 2.9079 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea. With a topological polar surface area (TPSA) of 53.16 Ų, 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]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-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea?
The CAS number of 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea is 701932-44-7.
What is the molecular formula of 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea?
The molecular formula of 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea is C13H15Cl2N3OS2.
What is the molecular weight of 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea?
The molecular weight of 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea is 363.00 g/mol.
Where can I buy 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea?
You can request a quote for 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]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-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-[(3,4-Dichlorophenyl)methylsulfanyl]acetyl]amino]-3-prop-2-enylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.