6-phenyl-3-(propan-2-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
Chemical Structure Depiction of
6-phenyl-3-(propan-2-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
6-phenyl-3-(propan-2-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8019-9597 |
| Compound Name: | 6-phenyl-3-(propan-2-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1) |
| Molecular Weight: | 339.25 |
| Molecular Formula: | C13 H14 N4 S |
| Salt: | HBr |
| Smiles: | CC(C)c1nnc2n1N=C(CS2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0499 |
| logD: | 3.0337 |
| logSw: | -2.9887 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.23 |
| InChI Key: | KYCAVBDHSJHMTR-UHFFFAOYSA-N |