N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-nitrobenzamide
Chemical Structure Depiction of
N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-nitrobenzamide
N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-nitrobenzamide
Compound characteristics
| Compound ID: | D305-0277 |
| Compound Name: | N-{2-[(4-ethylpiperazin-1-yl)methyl]-1-propyl-1H-benzimidazol-5-yl}-2-nitrobenzamide |
| Molecular Weight: | 450.54 |
| Molecular Formula: | C24 H30 N6 O3 |
| Smiles: | CCCn1c2ccc(cc2nc1CN1CCN(CC)CC1)NC(c1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.241 |
| logD: | 2.1302 |
| logSw: | -3.7817 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.834 |
| InChI Key: | UQAMEJBBFPRQAY-UHFFFAOYSA-N |