1-methyl-5-(5-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-3-yl)-1H-benzotriazole
Chemical Structure Depiction of
1-methyl-5-(5-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-3-yl)-1H-benzotriazole
1-methyl-5-(5-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-3-yl)-1H-benzotriazole
Compound characteristics
| Compound ID: | G944-0111 |
| Compound Name: | 1-methyl-5-(5-{[(4-methylpyrimidin-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-3-yl)-1H-benzotriazole |
| Molecular Weight: | 339.38 |
| Molecular Formula: | C15 H13 N7 O S |
| Smiles: | Cc1ccnc(n1)SCc1nc(c2ccc3c(c2)nnn3C)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.5256 |
| logD: | 2.5256 |
| logSw: | -2.5581 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.825 |
| InChI Key: | MLADYIJOSRZQHM-UHFFFAOYSA-N |