N-(4-{4-methyl-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1,2,5-oxadiazol-3-yl)acetamide
Chemical Structure Depiction of
N-(4-{4-methyl-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1,2,5-oxadiazol-3-yl)acetamide
N-(4-{4-methyl-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1,2,5-oxadiazol-3-yl)acetamide
Compound characteristics
| Compound ID: | D291-0149 |
| Compound Name: | N-(4-{4-methyl-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazol-3-yl}-1,2,5-oxadiazol-3-yl)acetamide |
| Molecular Weight: | 280.31 |
| Molecular Formula: | C10 H12 N6 O2 S |
| Smiles: | CC(Nc1c(c2nnc(n2C)SCC=C)non1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1999 |
| logD: | 1.1952 |
| logSw: | -2.1559 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.612 |
| InChI Key: | CJHVESGYXZCCOA-UHFFFAOYSA-N |