4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}-1-(2-methylbenzene-1-sulfonyl)piperidine
Chemical Structure Depiction of
4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}-1-(2-methylbenzene-1-sulfonyl)piperidine
4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}-1-(2-methylbenzene-1-sulfonyl)piperidine
Compound characteristics
| Compound ID: | S517-0510 |
| Compound Name: | 4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}-1-(2-methylbenzene-1-sulfonyl)piperidine |
| Molecular Weight: | 374.5 |
| Molecular Formula: | C19 H26 N4 O2 S |
| Smiles: | Cc1ccccc1S(N1CCC(CC1)Cc1nncn1CC1CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7647 |
| logD: | 2.7646 |
| logSw: | -3.0524 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.533 |
| InChI Key: | YKTXFYSRWSHKHT-UHFFFAOYSA-N |