N-{4-[5-(butylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-1,2,5-oxadiazol-3-yl}acetamide
Chemical Structure Depiction of
N-{4-[5-(butylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-1,2,5-oxadiazol-3-yl}acetamide
N-{4-[5-(butylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-1,2,5-oxadiazol-3-yl}acetamide
Compound characteristics
| Compound ID: | D291-0152 |
| Compound Name: | N-{4-[5-(butylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-1,2,5-oxadiazol-3-yl}acetamide |
| Molecular Weight: | 296.35 |
| Molecular Formula: | C11 H16 N6 O2 S |
| Smiles: | CCCCSc1nnc(c2c(NC(C)=O)non2)n1C |
| Stereo: | ACHIRAL |
| logP: | 1.9584 |
| logD: | 1.9536 |
| logSw: | -2.3319 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.612 |
| InChI Key: | JERJJSALLRCAPO-UHFFFAOYSA-N |