3-(2-nitrophenyl)-7-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
Chemical Structure Depiction of
3-(2-nitrophenyl)-7-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
3-(2-nitrophenyl)-7-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
Compound characteristics
| Compound ID: | 8017-8469 |
| Compound Name: | 3-(2-nitrophenyl)-7-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one |
| Molecular Weight: | 350.35 |
| Molecular Formula: | C17 H10 N4 O3 S |
| Smiles: | C1=C(c2ccccc2)Sc2nnc(c3ccccc3[N+]([O-])=O)n2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.8283 |
| logD: | 2.8283 |
| logSw: | -3.7831 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.937 |
| InChI Key: | FAIOFHDDUKGZPG-UHFFFAOYSA-N |