3-(benzenesulfonyl)-N-[1-(but-2-ynoyl)pyrrolidin-3-yl]propanamide
Chemical Structure Depiction of
3-(benzenesulfonyl)-N-[1-(but-2-ynoyl)pyrrolidin-3-yl]propanamide
3-(benzenesulfonyl)-N-[1-(but-2-ynoyl)pyrrolidin-3-yl]propanamide
Compound characteristics
| Compound ID: | T002-1270 |
| Compound Name: | 3-(benzenesulfonyl)-N-[1-(but-2-ynoyl)pyrrolidin-3-yl]propanamide |
| Molecular Weight: | 348.42 |
| Molecular Formula: | C17 H20 N2 O4 S |
| Smiles: | CC#CC(N1CCC(C1)NC(CCS(c1ccccc1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8256 |
| logD: | 0.8256 |
| logSw: | -2.2543 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.7 |
| InChI Key: | VKPIAHROYHSCHD-AWEZNQCLSA-N |