N-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-N'-(2-nitrophenyl)urea
Chemical Structure Depiction of
N-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-N'-(2-nitrophenyl)urea
N-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-N'-(2-nitrophenyl)urea
Compound characteristics
| Compound ID: | C301-7052 |
| Compound Name: | N-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-benzimidazol-5-yl]-N'-(2-nitrophenyl)urea |
| Molecular Weight: | 424.46 |
| Molecular Formula: | C21 H24 N6 O4 |
| Smiles: | CN1C(N(C)c2cc(c(cc12)NC(Nc1ccccc1[N+]([O-])=O)=O)N1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0778 |
| logD: | 4.0195 |
| logSw: | -4.2013 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.063 |
| InChI Key: | KKBSXWXNMZMPBQ-UHFFFAOYSA-N |