1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid
TL;DR: 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid (CAS 62848-45-7) is a chemical compound with molecular formula C11H9ClN2O3S and molecular weight 284.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(3-chlorophenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetic acid
Also Known As: 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid, 5-25-08-00193 (Beilstein Handbook Reference), 4-IMIDAZOLIDINEACETIC ACID, 1-(3-CHLOROPHENYL)-5-OXO-2-THIOXO-, 2-[1-(3-chlorophenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetic acid, [1-(3-Chlorophenyl)-5-oxo-2-sulfanyl-4,5-dihydro-1H-imidazol-4-yl]acetic acid
| Molecular Formula | C11H9ClN2O3S |
|---|---|
| Molecular Weight | 284.00 g/mol |
| LogP | 1.4044 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.00223 |
| Heavy Atoms | 18 |
| Complexity | 534.77454 |
Chemical Identifiers
| CAS Number | 62848-45-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)N2C(=O)C(NC2=S)CC(=O)O |
Product Overview
1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid (CAS 62848-45-7), with molecular formula C11H9ClN2O3S and molecular weight 284.00 g/mol. IUPAC: 2-[1-(3-chlorophenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetic acid.
Chemical Property Profile of 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid
Property Insights of 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid
The XLogP value of 1.4044 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid. Following Lipinski's Rule of Five, 1-(3-Chlorophenyl)-5-oxo-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 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid?
The CAS number of 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid is 62848-45-7.
What is the molecular formula of 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid?
The molecular formula of 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid is C11H9ClN2O3S.
What is the molecular weight of 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid?
The molecular weight of 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid is 284.00 g/mol.
Where can I buy 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid?
You can request a quote for 1-(3-Chlorophenyl)-5-oxo-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 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chlorophenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.