4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol
TL;DR: 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol (CAS 301682-10-0) is a chemical compound with molecular formula C10H13NO4S and molecular weight 243.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-hydroxyanilino)-1,1-dioxothiolan-3-ol
Also Known As: 4-(4-hydroxyanilino)-1,1-dioxothiolan-3-ol, 4-(4-hydroxyanilino)tetrahydro-3-thiophenol 1,1-dioxide, AE-641/11950475, 3-hydroxy-4-[(4-hydroxyphenyl)amino]thiolane-1,1-dione, 4-[(4-hydroxyphenyl)amino]tetrahydrothiophene-3-ol 1,1-dioxide
| Molecular Formula | C10H13NO4S |
|---|---|
| Molecular Weight | 243.06 g/mol |
| LogP | -0.038 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.05653 |
| Heavy Atoms | 16 |
| Complexity | 468.09732 |
Chemical Identifiers
| CAS Number | 301682-10-0 |
|---|---|
| SMILES | C1C(C(CS1(=O)=O)O)NC2=CC=C(C=C2)O |
Product Overview
4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol (CAS 301682-10-0), with molecular formula C10H13NO4S and molecular weight 243.06 g/mol. IUPAC: 4-(4-hydroxyanilino)-1,1-dioxothiolan-3-ol.
Chemical Property Profile of 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol
Property Insights of 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol
The XLogP value of -0.038 indicates that 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol. Following Lipinski's Rule of Five, 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol has 3 hydrogen bond donor(s) and 5 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 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol?
The CAS number of 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol is 301682-10-0.
What is the molecular formula of 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol?
The molecular formula of 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol is C10H13NO4S.
What is the molecular weight of 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol?
The molecular weight of 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol is 243.06 g/mol.
Where can I buy 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol?
You can request a quote for 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Hydroxyanilino)-1,1-dioxothiolan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.