1,3-diethyl-5-methyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
Chemical Structure Depiction of
1,3-diethyl-5-methyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
1,3-diethyl-5-methyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
Compound characteristics
| Compound ID: | 8020-2838 |
| Compound Name: | 1,3-diethyl-5-methyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one |
| Molecular Weight: | 249.27 |
| Molecular Formula: | C12 H15 N3 O3 |
| Smiles: | CCN1C(N(CC)c2cc(c(C)cc12)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0372 |
| logD: | 3.0372 |
| logSw: | -3.2619 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.922 |
| InChI Key: | ZSRJNJMBEUCWMK-UHFFFAOYSA-N |