N-{4-[3-(4-bromophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]phenyl}acetamide
Chemical Structure Depiction of
N-{4-[3-(4-bromophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]phenyl}acetamide
N-{4-[3-(4-bromophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]phenyl}acetamide
Compound characteristics
| Compound ID: | 8020-1576 |
| Compound Name: | N-{4-[3-(4-bromophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]phenyl}acetamide |
| Molecular Weight: | 428.31 |
| Molecular Formula: | C18 H14 Br N5 O S |
| Smiles: | CC(Nc1ccc(cc1)C1CSc2nnc(c3ccc(cc3)[Br])n2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0297 |
| logD: | 4.0261 |
| logSw: | -4.076 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.22 |
| InChI Key: | TVETXQNTBUDZBV-UHFFFAOYSA-N |