3-(2-methyl-1,3-thiazol-4-yl)-6-nitro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(2-methyl-1,3-thiazol-4-yl)-6-nitro-2H-1-benzopyran-2-one
3-(2-methyl-1,3-thiazol-4-yl)-6-nitro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1711-1169 |
| Compound Name: | 3-(2-methyl-1,3-thiazol-4-yl)-6-nitro-2H-1-benzopyran-2-one |
| Molecular Weight: | 288.28 |
| Molecular Formula: | C13 H8 N2 O4 S |
| Smiles: | Cc1nc(cs1)C1=Cc2cc(ccc2OC1=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8095 |
| logD: | 2.8095 |
| logSw: | -3.3737 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.082 |
| InChI Key: | GLWXFKNNQNFRQB-UHFFFAOYSA-N |