ethyl 4-{[1-ethyl-5-(3-methylbutanamido)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[1-ethyl-5-(3-methylbutanamido)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxylate
ethyl 4-{[1-ethyl-5-(3-methylbutanamido)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | D305-2879 |
| Compound Name: | ethyl 4-{[1-ethyl-5-(3-methylbutanamido)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxylate |
| Molecular Weight: | 415.54 |
| Molecular Formula: | C22 H33 N5 O3 |
| Smiles: | CCn1c2ccc(cc2nc1CN1CCN(CC1)C(=O)OCC)NC(CC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.268 |
| logD: | 3.1406 |
| logSw: | -3.3747 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.802 |
| InChI Key: | AVTWXTHLQWDFNS-UHFFFAOYSA-N |