2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-4-methyl-6-phenoxypyrimidine
Chemical Structure Depiction of
2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-4-methyl-6-phenoxypyrimidine
2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-4-methyl-6-phenoxypyrimidine
Compound characteristics
| Compound ID: | D396-0029 |
| Compound Name: | 2-[3-(benzylsulfanyl)-1H-1,2,4-triazol-1-yl]-4-methyl-6-phenoxypyrimidine |
| Molecular Weight: | 375.45 |
| Molecular Formula: | C20 H17 N5 O S |
| Smiles: | Cc1cc(nc(n1)n1cnc(n1)SCc1ccccc1)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3119 |
| logD: | 4.3117 |
| logSw: | -4.4808 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.581 |
| InChI Key: | GLYJFOQRTOWOIM-UHFFFAOYSA-N |