2-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-4,6-di(piperidin-1-yl)-1,3,5-triazine
Chemical Structure Depiction of
2-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-4,6-di(piperidin-1-yl)-1,3,5-triazine
2-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-4,6-di(piperidin-1-yl)-1,3,5-triazine
Compound characteristics
| Compound ID: | D441-0016 |
| Compound Name: | 2-{3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-4,6-di(piperidin-1-yl)-1,3,5-triazine |
| Molecular Weight: | 466.61 |
| Molecular Formula: | C23 H30 N8 O S |
| Smiles: | C1CCN(CC1)c1nc(nc(n1)n1cnc(n1)SCCOc1ccccc1)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 6.1602 |
| logD: | 6.1601 |
| logSw: | -6.0387 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.598 |
| InChI Key: | GVVFCOHKNFORRT-UHFFFAOYSA-N |