![3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione structure](/static/products/4436/443652-96-8.webp)
3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione
TL;DR: 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione (CAS 443652-96-8) is a chemical compound with molecular formula C11H14N2O3S2 and molecular weight 286.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,1-dioxothiolan-3-yl)-3-(4-hydroxyphenyl)thiourea
Also Known As: SDCCGMLS-0065113.P001, 3-({[(4-hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione, 1-(1,1-dioxothiolan-3-yl)-3-(4-hydroxyphenyl)thiourea, 1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-(4-hydroxyphenyl)thiourea
| Molecular Formula | C11H14N2O3S2 |
|---|---|
| Molecular Weight | 286.04 g/mol |
| LogP | 0.8657 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.0446 |
| Heavy Atoms | 18 |
| Complexity | 539.9117 |
Chemical Identifiers
| CAS Number | 443652-96-8 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1NC(=S)NC2=CC=C(C=C2)O |
Product Overview
3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione (CAS 443652-96-8), with molecular formula C11H14N2O3S2 and molecular weight 286.04 g/mol. IUPAC: 1-(1,1-dioxothiolan-3-yl)-3-(4-hydroxyphenyl)thiourea.
Chemical Property Profile of 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione
Property Insights of 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione
The XLogP value of 0.8657 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione. Following Lipinski's Rule of Five, 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione has 3 hydrogen bond donor(s) and 4 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 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione?
The CAS number of 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione is 443652-96-8.
What is the molecular formula of 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione?
The molecular formula of 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione is C11H14N2O3S2.
What is the molecular weight of 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione?
The molecular weight of 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione is 286.04 g/mol.
Where can I buy 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione?
You can request a quote for 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-({[(4-Hydroxyphenyl)amino]thioxomethyl}amino)thiolane-1,1-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.