3-(5-chloro-2-methoxyphenyl)-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
Chemical Structure Depiction of
3-(5-chloro-2-methoxyphenyl)-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
3-(5-chloro-2-methoxyphenyl)-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8019-5557 |
| Compound Name: | 3-(5-chloro-2-methoxyphenyl)-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine--hydrogen bromide (1/1) |
| Molecular Weight: | 472.19 |
| Molecular Formula: | C17 H12 Cl2 N4 O S |
| Salt: | HBr |
| Smiles: | COc1ccc(cc1c1nnc2n1N=C(CS2)c1ccc(cc1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8637 |
| logD: | 4.8617 |
| logSw: | -4.9537 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.589 |
| InChI Key: | CUZHTVFUHSFAJX-UHFFFAOYSA-N |