5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid
TL;DR: 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid (CAS 5624-13-5) is a chemical compound with molecular formula C11H10N2O3S and molecular weight 250.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl)acetic acid
Also Known As: Pth-aspartic acid, Phenylthiohydantoin-aspartic Acid, Aspartic phenylthiohydantoin, 3-Phenyl-2-thiohydantoin-5-acetic acid, Aspartic acid phenylthiohydantoin
| Molecular Formula | C11H10N2O3S |
|---|---|
| Molecular Weight | 250.04 g/mol |
| LogP | 0.751 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.04121 |
| Heavy Atoms | 17 |
| Complexity | 474.86472 |
Chemical Identifiers
| CAS Number | 5624-13-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C(NC2=S)CC(=O)O |
Product Overview
5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid (CAS 5624-13-5), with molecular formula C11H10N2O3S and molecular weight 250.04 g/mol. IUPAC: 2-(5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl)acetic acid.
Chemical Property Profile of 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid
Property Insights of 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid
The XLogP value of 0.751 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid. Following Lipinski's Rule of Five, 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid 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 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid?
The CAS number of 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid is 5624-13-5.
What is the molecular formula of 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid?
The molecular formula of 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid is C11H10N2O3S.
What is the molecular weight of 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid?
The molecular weight of 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid is 250.04 g/mol.
Where can I buy 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid?
You can request a quote for 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.