2-(4-methylphenyl)-5-(3-nitrophenyl)-5,6-dihydro-7H-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one
Chemical Structure Depiction of
2-(4-methylphenyl)-5-(3-nitrophenyl)-5,6-dihydro-7H-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one
2-(4-methylphenyl)-5-(3-nitrophenyl)-5,6-dihydro-7H-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one
Compound characteristics
| Compound ID: | 5311-0343 |
| Compound Name: | 2-(4-methylphenyl)-5-(3-nitrophenyl)-5,6-dihydro-7H-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one |
| Molecular Weight: | 366.4 |
| Molecular Formula: | C18 H14 N4 O3 S |
| Smiles: | Cc1ccc(cc1)c1nc2n(C(CC(c3cccc(c3)[N+]([O-])=O)S2)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2752 |
| logD: | 4.2752 |
| logSw: | -4.4201 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.489 |
| InChI Key: | HBUMYZBRQSSBIF-HNNXBMFYSA-N |