(S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate
TL;DR: (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate (CAS 1173676-53-3) is a chemical compound with molecular formula C15H23N3O5S and molecular weight 357.13583 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl (2S)-2-[5-(2-ethoxy-2-oxoethyl)sulfanyl-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate
Also Known As: (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate, tert-butyl (2S)-2-[5-(2-ethoxy-2-oxoethyl)sulfanyl-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate
Technical Specifications
| Molecular Formula | C15H23N3O5S |
| Molecular Weight | 357.13583 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 357.13583 Da |
| Heavy Atoms | 24 |
| Complexity | 457.0 |
| SMILES | CCOC(=O)CSC1=NN=C(O1)[C@@H]2CCCN2C(=O)OC(C)(C)C |
| InChIKey | DQYMXFZCEPNKCH-JTQLQIEISA-N |
Chemical Property Profile of (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate
Property Insights of (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate. Following Lipinski's Rule of Five, (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate?
The CAS number of (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate is 1173676-53-3.
What is the molecular formula of (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate?
The molecular formula of (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate is C15H23N3O5S.
What is the molecular weight of (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate?
The molecular weight of (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate is 357.13583 g/mol.
Where can I buy (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate?
You can request a quote for (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate?
Yes, CoreyChem provides custom synthesis services for (S)-tert-butyl 2-(5-((2-ethoxy-2-oxoethyl)thio)-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.