(1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid
TL;DR: (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid (CAS 1435-52-5) is a chemical compound with molecular formula C12H12N2O3S and molecular weight 264.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)acetic acid
Also Known As: d(+)-kampharimide, (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid, -ACETICACID, 1,4-Dibromo-2-fluorobenzene, TIMTEC-BB SBB007421
| Molecular Formula | C12H12N2O3S |
|---|---|
| Molecular Weight | 264.06 g/mol |
| LogP | 0.7466 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.05685 |
| Heavy Atoms | 18 |
| Complexity | 489.3557 |
Chemical Identifiers
| CAS Number | 1435-52-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)C(NC2=S)CC(=O)O |
Product Overview
(1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid (CAS 1435-52-5), with molecular formula C12H12N2O3S and molecular weight 264.06 g/mol. IUPAC: 2-(1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)acetic acid.
Chemical Property Profile of (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid
Property Insights of (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid
The XLogP value of 0.7466 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid. Following Lipinski's Rule of Five, (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic 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-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid?
The CAS number of (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid is 1435-52-5.
What is the molecular formula of (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid?
The molecular formula of (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid is C12H12N2O3S.
What is the molecular weight of (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid?
The molecular weight of (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid is 264.06 g/mol.
Where can I buy (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid?
You can request a quote for (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (1-Benzyl-5-oxo-2-thioxo-imidazolidin-4-yl)-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.