7-(4-methylphenyl)-3-(3-nitrophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
Chemical Structure Depiction of
7-(4-methylphenyl)-3-(3-nitrophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
7-(4-methylphenyl)-3-(3-nitrophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
Compound characteristics
| Compound ID: | 8017-8478 |
| Compound Name: | 7-(4-methylphenyl)-3-(3-nitrophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one |
| Molecular Weight: | 364.38 |
| Molecular Formula: | C18 H12 N4 O3 S |
| Smiles: | Cc1ccc(cc1)C1=CC(n2c(c3cccc(c3)[N+]([O-])=O)nnc2S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9232 |
| logD: | 3.9232 |
| logSw: | -4.0245 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.238 |
| InChI Key: | GDOLUBQPUZIVSN-UHFFFAOYSA-N |