3-{[1-(benzenesulfonyl)pyrrolidin-3-yl]methyl}-4-benzyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[1-(benzenesulfonyl)pyrrolidin-3-yl]methyl}-4-benzyl-4H-1,2,4-triazole
3-{[1-(benzenesulfonyl)pyrrolidin-3-yl]methyl}-4-benzyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | P936-3560 |
| Compound Name: | 3-{[1-(benzenesulfonyl)pyrrolidin-3-yl]methyl}-4-benzyl-4H-1,2,4-triazole |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C20 H22 N4 O2 S |
| Smiles: | C1CN(CC1Cc1nncn1Cc1ccccc1)S(c1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6276 |
| logD: | 2.6276 |
| logSw: | -2.8969 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.31 |
| InChI Key: | CRUSADDQMQJSOW-SFHVURJKSA-N |