![3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate structure](/static/products/436/436855-68-4.png)
3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate
TL;DR: 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate (CAS 436855-68-4) is a chemical compound with molecular formula C9H11N2O3S- and molecular weight 227.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylideneimidazolidin-4-yl]propanoate
Also Known As: 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate, 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylideneimidazolidin-4-yl]propanoate
| Molecular Formula | C9H11N2O3S- |
|---|---|
| Molecular Weight | 227.05 g/mol |
| LogP | -1.2122 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.04904 |
| Heavy Atoms | 15 |
| Complexity | 316.4793 |
Chemical Identifiers
| CAS Number | 436855-68-4 |
|---|---|
| SMILES | C=CCN1C(=O)[C@@H](NC1=S)CCC(=O)[O-] |
Product Overview
3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate (CAS 436855-68-4), with molecular formula C9H11N2O3S- and molecular weight 227.05 g/mol. IUPAC: 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylideneimidazolidin-4-yl]propanoate.
Chemical Property Profile of 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate
Property Insights of 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate
The XLogP value of -1.2122 indicates that 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate. Following Lipinski's Rule of Five, 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate has 1 hydrogen bond donor(s) and 4 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 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate?
The CAS number of 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate is 436855-68-4.
What is the molecular formula of 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate?
The molecular formula of 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate is C9H11N2O3S-.
What is the molecular weight of 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate?
The molecular weight of 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate is 227.05 g/mol.
Where can I buy 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate?
You can request a quote for 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4S)-5-oxo-1-prop-2-enyl-2-sulfanylidene-imidazolidin-4-yl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.