ethyl 4-{[1-ethyl-5-(3-nitrobenzamido)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[1-ethyl-5-(3-nitrobenzamido)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxylate
ethyl 4-{[1-ethyl-5-(3-nitrobenzamido)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | D305-2891 |
| Compound Name: | ethyl 4-{[1-ethyl-5-(3-nitrobenzamido)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxylate |
| Molecular Weight: | 480.52 |
| Molecular Formula: | C24 H28 N6 O5 |
| Smiles: | CCn1c2ccc(cc2nc1CN1CCN(CC1)C(=O)OCC)NC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4156 |
| logD: | 3.4081 |
| logSw: | -3.6387 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.125 |
| InChI Key: | MXMSKVPDVIADDF-UHFFFAOYSA-N |