3-(4-acetylphenyl)-7-[(3-nitrophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
3-(4-acetylphenyl)-7-[(3-nitrophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
3-(4-acetylphenyl)-7-[(3-nitrophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
| Compound ID: | 4268-0034 |
| Compound Name: | 3-(4-acetylphenyl)-7-[(3-nitrophenyl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 408.43 |
| Molecular Formula: | C20 H16 N4 O4 S |
| Smiles: | CC(c1ccc(cc1)N1CN=C2N(C1)C(/C(=C/c1cccc(c1)[N+]([O-])=O)S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9551 |
| logD: | 3.9293 |
| logSw: | -4.0706 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.714 |
| InChI Key: | VQBQNVFOFVMDJE-UHFFFAOYSA-N |