N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-4-nitro-1H-imidazole-5-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-4-nitro-1H-imidazole-5-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-4-nitro-1H-imidazole-5-carboxamide
Compound characteristics
| Compound ID: | 8018-2115 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-4-nitro-1H-imidazole-5-carboxamide |
| Molecular Weight: | 304.26 |
| Molecular Formula: | C13 H12 N4 O5 |
| Smiles: | Cn1cnc(c1C(Nc1ccc2c(c1)OCCO2)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.2113 |
| logD: | -0.0954 |
| logSw: | -2.1089 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.019 |
| InChI Key: | ATXADUGNHJOJQO-UHFFFAOYSA-N |