2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-4,6-di(piperidin-1-yl)-1,3,5-triazine
Chemical Structure Depiction of
2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-4,6-di(piperidin-1-yl)-1,3,5-triazine
2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-4,6-di(piperidin-1-yl)-1,3,5-triazine
Compound characteristics
| Compound ID: | D441-0062 |
| Compound Name: | 2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-4,6-di(piperidin-1-yl)-1,3,5-triazine |
| Molecular Weight: | 436.58 |
| Molecular Formula: | C22 H28 N8 S |
| Smiles: | C1CCN(CC1)c1nc(nc(n1)n1cnc(n1)SCc1ccccc1)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 6.0359 |
| logD: | 6.0358 |
| logSw: | -6.165 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.181 |
| InChI Key: | JPNCHDDPBBUEHX-UHFFFAOYSA-N |