Captopril N-ethylmaleimide sulfone
TL;DR: Captopril N-ethylmaleimide sulfone (CAS 1193-00-6) is a chemical compound with molecular formula C15H22N2O7S and molecular weight 374.11478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-1-[3-(1-ethyl-2,5-dioxopyrrolidin-3-yl)sulfonyl-2-methylpropanoyl]pyrrolidine-2-carboxylic acid
Also Known As: Captopril nem sulfone, Captopril N-ethylmaleimide sulfone, [(4-chlorophenoxy)methyl] methylcyanocarbonimidodithioate, 1-{3-[(1-ethyl-2,5-dioxopyrrolidin-3-yl)sulfonyl]-2-methylpropanoyl}-l-proline, (2S)-1-[3-(1-ethyl-2,5-dioxopyrrolidin-3-yl)sulfonyl-2-methylpropanoyl]pyrrolidine-2-carboxylic acid
Technical Specifications
| Molecular Formula | C15H22N2O7S |
| Molecular Weight | 374.11478 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 138.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 374.11478 Da |
| Heavy Atoms | 25 |
| Complexity | 697.0 |
| SMILES | CCN1C(=O)CC(C1=O)S(=O)(=O)CC(C)C(=O)N2CCC[C@H]2C(=O)O |
| InChIKey | QWTSOKYMUPGXNF-YVNMAJEFSA-N |
Chemical Property Profile of Captopril N-ethylmaleimide sulfone
Property Insights of Captopril N-ethylmaleimide sulfone
The XLogP value of -0.9 indicates that Captopril N-ethylmaleimide sulfone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Captopril N-ethylmaleimide sulfone. Following Lipinski's Rule of Five, Captopril N-ethylmaleimide sulfone has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Captopril N-ethylmaleimide sulfone?
The CAS number of Captopril N-ethylmaleimide sulfone is 1193-00-6.
What is the molecular formula of Captopril N-ethylmaleimide sulfone?
The molecular formula of Captopril N-ethylmaleimide sulfone is C15H22N2O7S.
What is the molecular weight of Captopril N-ethylmaleimide sulfone?
The molecular weight of Captopril N-ethylmaleimide sulfone is 374.11478 g/mol.
Where can I buy Captopril N-ethylmaleimide sulfone?
You can request a quote for Captopril N-ethylmaleimide sulfone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Captopril N-ethylmaleimide sulfone?
Yes, CoreyChem provides custom synthesis services for Captopril N-ethylmaleimide sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.