ethyl 4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazine-1-carboxylate
ethyl 4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | D305-2830 |
| Compound Name: | ethyl 4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazine-1-carboxylate |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C16 H21 N5 O4 |
| Smiles: | CCOC(N1CCN(CC1)Cc1nc2cc(ccc2n1C)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8194 |
| logD: | 1.8148 |
| logSw: | -2.3214 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.119 |
| InChI Key: | ZOFSYOAOMNFUIN-UHFFFAOYSA-N |