2-[(3-nitrophenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Chemical Structure Depiction of
2-[(3-nitrophenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
2-[(3-nitrophenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Compound characteristics
| Compound ID: | 4491-0641 |
| Compound Name: | 2-[(3-nitrophenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione |
| Molecular Weight: | 302.27 |
| Molecular Formula: | C12 H6 N4 O4 S |
| Smiles: | C(=C1/C(N2C(=NC(C=N2)=O)S1)=O)\c1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.8989 |
| logD: | 0.8989 |
| logSw: | -2.133 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.008 |
| InChI Key: | JVPBNYUWBWBCKN-UHFFFAOYSA-N |