2-{[5-(2-methylfuran-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-{[5-(2-methylfuran-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3,4-thiadiazol-2-yl)acetamide
2-{[5-(2-methylfuran-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | Y205-9953 |
| Compound Name: | 2-{[5-(2-methylfuran-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C14 H14 N6 O2 S2 |
| Smiles: | Cc1c(cco1)c1nnc(n1CC=C)SCC(Nc1nncs1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7245 |
| logD: | 1.7201 |
| logSw: | -2.6033 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.177 |
| InChI Key: | LQHMBQJZXWBLDG-UHFFFAOYSA-N |