4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo-
TL;DR: 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo- (CAS 66326-04-3) is a chemical compound with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methyl-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl)propanoic acid
Also Known As: 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo-, BAS 00470849, 3-(4-methyl-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl)propanoic acid, 5-(beta-carboxyethyl)-5-methyl-3-phenyl-2-thiohydantoin, 3-(4-methyl-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl)
| Molecular Formula | C13H14N2O3S |
|---|---|
| Molecular Weight | 278.07 g/mol |
| LogP | 1.5312 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.0725 |
| Heavy Atoms | 19 |
| Complexity | 531.9497 |
Chemical Identifiers
| CAS Number | 66326-04-3 |
|---|---|
| SMILES | CC1(C(=O)N(C(=S)N1)C2=CC=CC=C2)CCC(=O)O |
Product Overview
4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo- (CAS 66326-04-3), with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol. IUPAC: 3-(4-methyl-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl)propanoic acid.
Chemical Property Profile of 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo-
Property Insights of 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo-
The XLogP value of 1.5312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo-. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo-. Following Lipinski's Rule of Five, 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo- 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-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo-?
The CAS number of 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo- is 66326-04-3.
What is the molecular formula of 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo-?
The molecular formula of 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo- is C13H14N2O3S.
What is the molecular weight of 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo-?
The molecular weight of 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo- is 278.07 g/mol.
Where can I buy 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo-?
You can request a quote for 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 4-Imidazolidinepropanoic acid, 4-methyl-5-oxo-1-phenyl-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.