3-[(4-chlorophenyl)methyl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
3-[(4-chlorophenyl)methyl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | G786-0609 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1) |
| Molecular Weight: | 421.74 |
| Molecular Formula: | C17 H13 Cl N4 S |
| Salt: | HBr |
| Smiles: | C(c1ccc(cc1)[Cl])c1nnc2n1N=C(CS2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1171 |
| logD: | 4.0905 |
| logSw: | -4.6322 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.934 |
| InChI Key: | HOZAUINXOHZAGV-UHFFFAOYSA-N |