![1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline structure](/static/products/477/477528-89-5.png)
1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline
TL;DR: 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline (CAS 477528-89-5) is a chemical compound with molecular formula C12H19NO3S2 and molecular weight 289.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-[(2S)-2-methyl-3-(prop-2-enyldisulfanyl)propanoyl]pyrrolidine-2-carboxylic acid
Also Known As: 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline, 1-{(2S)-2-Methyl-3-[(prop-2-en-1-yl)disulfanyl]propanoyl}-L-proline, (2S)-1-[(2R)-2-methyl-3-prop-2-enyldisulfanyl-propanoyl]pyrrolidine-2-carboxylic Acid
| Molecular Formula | C12H19NO3S2 |
|---|---|
| Molecular Weight | 289.08 g/mol |
| LogP | 2.2655 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 289.08063 |
| Heavy Atoms | 18 |
| Complexity | 322.4444 |
Chemical Identifiers
| CAS Number | 477528-89-5 |
|---|---|
| SMILES | C[C@H](CSSCC=C)C(=O)N1CCC[C@H]1C(=O)O |
Product Overview
1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline (CAS 477528-89-5), with molecular formula C12H19NO3S2 and molecular weight 289.08 g/mol. IUPAC: (2S)-1-[(2S)-2-methyl-3-(prop-2-enyldisulfanyl)propanoyl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline
Property Insights of 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline
The XLogP value of 2.2655 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline. With a topological polar surface area (TPSA) of 57.61 Ų, 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline 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 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline?
The CAS number of 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline is 477528-89-5.
What is the molecular formula of 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline?
The molecular formula of 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline is C12H19NO3S2.
What is the molecular weight of 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline?
The molecular weight of 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline is 289.08 g/mol.
Where can I buy 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline?
You can request a quote for 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2S)-2-Methyl-1-oxo-3-(2-propen-1-yldithio)propyl]-L-proline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.