1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)-2-methyl-5-nitro-1H-imidazole
Chemical Structure Depiction of
1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)-2-methyl-5-nitro-1H-imidazole
1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)-2-methyl-5-nitro-1H-imidazole
Compound characteristics
| Compound ID: | 8468-0064 |
| Compound Name: | 1-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)-2-methyl-5-nitro-1H-imidazole |
| Molecular Weight: | 325.3 |
| Molecular Formula: | C12 H11 N3 O6 S |
| Smiles: | Cc1ncc([N+]([O-])=O)n1S(c1ccc2c(c1)OCCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.399 |
| logD: | 0.399 |
| logSw: | -2.1004 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 86.898 |
| InChI Key: | IYMJKRYHJSLLLL-UHFFFAOYSA-N |