{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(1-{1-[(3-fluorophenyl)methyl]-1H-benzimidazol-2-yl}piperidin-4-yl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(1-{1-[(3-fluorophenyl)methyl]-1H-benzimidazol-2-yl}piperidin-4-yl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(1-{1-[(3-fluorophenyl)methyl]-1H-benzimidazol-2-yl}piperidin-4-yl)methanone
Compound characteristics
| Compound ID: | C776-1721 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(1-{1-[(3-fluorophenyl)methyl]-1H-benzimidazol-2-yl}piperidin-4-yl)methanone |
| Molecular Weight: | 555.65 |
| Molecular Formula: | C32 H34 F N5 O3 |
| Smiles: | C1CN(CCC1C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)c1nc2ccccc2n1Cc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.1006 |
| logD: | 4.6323 |
| logSw: | -5.2675 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.465 |
| InChI Key: | ZYQBSHNPIDSKBJ-UHFFFAOYSA-N |