3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one
TL;DR: 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one (CAS 338777-60-9) is a chemical compound with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxy-1-phenylethyl)-2-sulfanylideneimidazolidin-4-one
Also Known As: 3-(2-Hydroxy-1-phenylethyl)-2-thioxoimidazolidin-4-one, 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one, 3-(2-hydroxy-1-phenylethyl)-2-sulfanylideneimidazolidin-4-one, hydroxyphenylethylthioxotetrahydroimidazolone, 3-(2-Hydroxy-1-phenylethyl)-2-thiohydantoin, 95%
| Molecular Formula | C11H12N2O2S |
|---|---|
| Molecular Weight | 236.06 g/mol |
| LogP | 0.4367 |
| Topological Polar Surface Area | 52.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.06195 |
| Heavy Atoms | 16 |
| Complexity | 391.7054 |
Chemical Identifiers
| CAS Number | 338777-60-9 |
|---|---|
| SMILES | C1C(=O)N(C(=S)N1)C(CO)C2=CC=CC=C2 |
Product Overview
3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one (CAS 338777-60-9), with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol. IUPAC: 3-(2-hydroxy-1-phenylethyl)-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one
Property Insights of 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one
The XLogP value of 0.4367 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one. With a topological polar surface area (TPSA) of 52.57 Ų, 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one has 2 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 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one?
The CAS number of 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one is 338777-60-9.
What is the molecular formula of 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one?
The molecular formula of 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one is C11H12N2O2S.
What is the molecular weight of 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one?
The molecular weight of 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one is 236.06 g/mol.
Where can I buy 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one?
You can request a quote for 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-hydroxy-1-phenylethyl)-2-thioxotetrahydro-4H-imidazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.