(S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide
TL;DR: (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide (CAS 1173676-07-7) is a chemical compound with molecular formula C13H15N3O4S2 and molecular weight 341.05038 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-N-(5-methyl-1,2-oxazol-3-yl)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide
Also Known As: N-(5-methyl-1,2-oxazol-3-yl)-1-(thiophen-2-ylsulfonyl)-L-prolinamide, (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide
Technical Specifications
| Molecular Formula | C13H15N3O4S2 |
| Molecular Weight | 341.05038 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.05038 Da |
| Heavy Atoms | 22 |
| Complexity | 522.0 |
| SMILES | CC1=CC(=NO1)NC(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=CS3 |
| InChIKey | XLLGWKCRIAENDE-JTQLQIEISA-N |
Chemical Property Profile of (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide
Property Insights of (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide. Following Lipinski's Rule of Five, (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide 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 (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide?
The CAS number of (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide is 1173676-07-7.
What is the molecular formula of (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide?
The molecular formula of (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide is C13H15N3O4S2.
What is the molecular weight of (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide?
The molecular weight of (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide is 341.05038 g/mol.
Where can I buy (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide?
You can request a quote for (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide?
Yes, CoreyChem provides custom synthesis services for (S)-N-(5-methylisoxazol-3-yl)-1-(thiophen-2-ylsulfonyl)pyrrolidine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.