5-[(3S)-1,2-dithiolan-3-yl]-N-[(1-methyl-1H-pyrrol-2-yl)methyl]pentanamide
Chemical Structure Depiction of
5-[(3S)-1,2-dithiolan-3-yl]-N-[(1-methyl-1H-pyrrol-2-yl)methyl]pentanamide
5-[(3S)-1,2-dithiolan-3-yl]-N-[(1-methyl-1H-pyrrol-2-yl)methyl]pentanamide
Compound characteristics
| Compound ID: | Y043-2969 |
| Compound Name: | 5-[(3S)-1,2-dithiolan-3-yl]-N-[(1-methyl-1H-pyrrol-2-yl)methyl]pentanamide |
| Molecular Weight: | 298.47 |
| Molecular Formula: | C14 H22 N2 O S2 |
| Smiles: | Cn1cccc1CNC(CCCC[C@H]1CCSS1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.9257 |
| logD: | 2.9257 |
| logSw: | -3.3056 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.8942 |
| InChI Key: | XWJRNXXXTNIWMG-ZDUSSCGKSA-N |