3-[(2-methylpropyl)sulfanyl]-10H-[1,2,4]triazolo[4',3':2,3][1,2,4]triazino[5,6-b]indole
Chemical Structure Depiction of
3-[(2-methylpropyl)sulfanyl]-10H-[1,2,4]triazolo[4',3':2,3][1,2,4]triazino[5,6-b]indole
3-[(2-methylpropyl)sulfanyl]-10H-[1,2,4]triazolo[4',3':2,3][1,2,4]triazino[5,6-b]indole
Compound characteristics
| Compound ID: | 4896-3076 |
| Compound Name: | 3-[(2-methylpropyl)sulfanyl]-10H-[1,2,4]triazolo[4',3':2,3][1,2,4]triazino[5,6-b]indole |
| Molecular Weight: | 298.37 |
| Molecular Formula: | C14 H14 N6 S |
| Smiles: | CC(C)CSc1nnc2nc3c(c4ccccc4[nH]3)nn12 |
| Stereo: | ACHIRAL |
| logP: | 2.6366 |
| logD: | 2.6366 |
| logSw: | -2.9238 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.442 |
| InChI Key: | DBKGMRXUJYVCDZ-UHFFFAOYSA-N |