N-(2H-1,3-benzodioxol-5-yl)-4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxamide
Compound characteristics
| Compound ID: | L277-0090 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-2-yl]methyl}piperazine-1-carboxamide |
| Molecular Weight: | 490.56 |
| Molecular Formula: | C26 H30 N6 O4 |
| Smiles: | Cn1c2ccc(cc2nc1CN1CCN(CC1)C(Nc1ccc2c(c1)OCO2)=O)C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8972 |
| logD: | 1.4525 |
| logSw: | -2.7833 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.364 |
| InChI Key: | ZESQJDKPQKULJE-UHFFFAOYSA-N |