1-Phenyl-2-thioxoimidazolidine-4,5-dione
TL;DR: 1-Phenyl-2-thioxoimidazolidine-4,5-dione (CAS 2387-70-4) is a chemical compound with molecular formula C9H6N2O2S and molecular weight 206.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-sulfanylideneimidazolidine-4,5-dione
Also Known As: 1-phenyl-2-thioxoimidazolidine-4,5-dione, 1-phenyl-2-sulfanylimidazole-4,5-dione, NCI60_025234, 1-Phenyl-2-thioxo-4,5-imidazolidinedione, 1-phenyl-2-sulfanylideneimidazolidine-4,5-dione
| Molecular Formula | C9H6N2O2S |
|---|---|
| Molecular Weight | 206.01 g/mol |
| LogP | 0.4343 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.015 |
| Heavy Atoms | 14 |
| Complexity | 416.07996 |
Chemical Identifiers
| CAS Number | 2387-70-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C(=O)NC2=S |
Product Overview
1-Phenyl-2-thioxoimidazolidine-4,5-dione (CAS 2387-70-4), with molecular formula C9H6N2O2S and molecular weight 206.01 g/mol. IUPAC: 1-phenyl-2-sulfanylideneimidazolidine-4,5-dione.
Chemical Property Profile of 1-Phenyl-2-thioxoimidazolidine-4,5-dione
Property Insights of 1-Phenyl-2-thioxoimidazolidine-4,5-dione
The XLogP value of 0.4343 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-2-thioxoimidazolidine-4,5-dione. With a topological polar surface area (TPSA) of 49.41 Ų, 1-Phenyl-2-thioxoimidazolidine-4,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-2-thioxoimidazolidine-4,5-dione has 1 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-Phenyl-2-thioxoimidazolidine-4,5-dione?
The CAS number of 1-Phenyl-2-thioxoimidazolidine-4,5-dione is 2387-70-4.
What is the molecular formula of 1-Phenyl-2-thioxoimidazolidine-4,5-dione?
The molecular formula of 1-Phenyl-2-thioxoimidazolidine-4,5-dione is C9H6N2O2S.
What is the molecular weight of 1-Phenyl-2-thioxoimidazolidine-4,5-dione?
The molecular weight of 1-Phenyl-2-thioxoimidazolidine-4,5-dione is 206.01 g/mol.
Where can I buy 1-Phenyl-2-thioxoimidazolidine-4,5-dione?
You can request a quote for 1-Phenyl-2-thioxoimidazolidine-4,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-2-thioxoimidazolidine-4,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-2-thioxoimidazolidine-4,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.