2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
Chemical Structure Depiction of
2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide
Compound characteristics
| Compound ID: | 8009-1331 |
| Compound Name: | 2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]acetamide |
| Molecular Weight: | 489.62 |
| Molecular Formula: | C24 H23 N7 O S2 |
| Smiles: | CC(C)c1nnc(NC(CSc2nc3c(c4ccccc4n3CCc3ccccc3)nn2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.0043 |
| logD: | 4.9587 |
| logSw: | -4.7763 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.38 |
| InChI Key: | YRUOVNHFSMRDBU-UHFFFAOYSA-N |