1,3-bis{[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}propan-2-one
Chemical Structure Depiction of
1,3-bis{[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}propan-2-one
1,3-bis{[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}propan-2-one
Compound characteristics
| Compound ID: | 8019-3972 |
| Compound Name: | 1,3-bis{[5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}propan-2-one |
| Molecular Weight: | 496.61 |
| Molecular Formula: | C23 H24 N6 O3 S2 |
| Smiles: | Cn1c(c2ccc(cc2)OC)nnc1SCC(CSc1nnc(c2ccc(cc2)OC)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6236 |
| logD: | 3.6236 |
| logSw: | -3.762 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.978 |
| InChI Key: | XGFHFLOZMFASNH-UHFFFAOYSA-N |