N-[1,3-dimethyl-2-oxo-6-(pyrrolidin-1-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-4-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-[1,3-dimethyl-2-oxo-6-(pyrrolidin-1-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-4-methyl-3-nitrobenzamide
N-[1,3-dimethyl-2-oxo-6-(pyrrolidin-1-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-4-methyl-3-nitrobenzamide
Compound characteristics
Compound ID: | C301-6333 |
Compound Name: | N-[1,3-dimethyl-2-oxo-6-(pyrrolidin-1-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-4-methyl-3-nitrobenzamide |
Molecular Weight: | 409.44 |
Molecular Formula: | C21 H23 N5 O4 |
Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(Nc1cc2c(cc1N1CCCC1)N(C)C(N2C)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8705 |
logD: | 2.4894 |
logSw: | -4.0153 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.915 |
InChI Key: | NLNOLSNAQRHTJW-UHFFFAOYSA-N |