6-methyl-2-[(2-nitrophenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Chemical Structure Depiction of
6-methyl-2-[(2-nitrophenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
6-methyl-2-[(2-nitrophenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Compound characteristics
| Compound ID: | 5629-1103 |
| Compound Name: | 6-methyl-2-[(2-nitrophenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione |
| Molecular Weight: | 316.29 |
| Molecular Formula: | C13 H8 N4 O4 S |
| Smiles: | [H]C(=C1/C(N2C(=NC(C(C)=N2)=O)S1)=O)\c1ccccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.5435 |
| logD: | 1.5435 |
| logSw: | -2.1854 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.174 |
| InChI Key: | CQDFGYNFCRBNFJ-UHFFFAOYSA-N |