4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate
TL;DR: 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate (CAS 62848-43-5) is a chemical compound with molecular formula C12H14N2O4S and molecular weight 282.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(4-methylphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetic acid;hydrate
Also Known As: 1-(4-Methylphenyl)-5-oxo-2-thioxo-4-imidazolidineacetic acid hydrate, 4-IMIDAZOLIDINEACETIC ACID, 1-(4-METHYLPHENYL)-5-OXO-2-THIOXO-, HYDRATE, 2-[1-(4-methylphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetic acid hydrate, [1-(4-Methylphenyl)-5-oxo-2-sulfanyl-4,5-dihydro-1H-imidazol-4-yl]acetic acid--water (1/1), RefChem:293453
| Molecular Formula | C12H14N2O4S |
|---|---|
| Molecular Weight | 282.07 g/mol |
| LogP | 0.23472 |
| Topological Polar Surface Area | 101.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.0674 |
| Heavy Atoms | 19 |
| Complexity | 514.9656 |
Chemical Identifiers
| CAS Number | 62848-43-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C(NC2=S)CC(=O)O.O |
Product Overview
4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate (CAS 62848-43-5), with molecular formula C12H14N2O4S and molecular weight 282.07 g/mol. IUPAC: 2-[1-(4-methylphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetic acid;hydrate.
Chemical Property Profile of 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate
Property Insights of 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate
The XLogP value of 0.23472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate. The TPSA of 101.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate. Following Lipinski's Rule of Five, 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate 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 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate?
The CAS number of 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate is 62848-43-5.
What is the molecular formula of 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate?
The molecular formula of 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate is C12H14N2O4S.
What is the molecular weight of 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate?
The molecular weight of 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate is 282.07 g/mol.
Where can I buy 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate?
You can request a quote for 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate?
Yes, KEHONG BIO provides custom synthesis services for 4-Imidazolidineacetic acid, 1-(4-methylphenyl)-5-oxo-2-thioxo-, hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.