2-{[5-(4-acetamido-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexylacetamide
Chemical Structure Depiction of
2-{[5-(4-acetamido-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexylacetamide
2-{[5-(4-acetamido-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexylacetamide
Compound characteristics
| Compound ID: | D291-0087 |
| Compound Name: | 2-{[5-(4-acetamido-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexylacetamide |
| Molecular Weight: | 393.47 |
| Molecular Formula: | C16 H23 N7 O3 S |
| Smiles: | CCn1c(c2c(NC(C)=O)non2)nnc1SCC(NC1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.933 |
| logD: | 1.9283 |
| logSw: | -2.4549 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.452 |
| InChI Key: | LWKVTALDSARKBU-UHFFFAOYSA-N |