4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperidine-1-carboxamide
Chemical Structure Depiction of
4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperidine-1-carboxamide
4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperidine-1-carboxamide
Compound characteristics
| Compound ID: | S517-0999 |
| Compound Name: | 4-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperidine-1-carboxamide |
| Molecular Weight: | 433.51 |
| Molecular Formula: | C24 H27 N5 O3 |
| Smiles: | C1CN(CCC1Cc1nncn1Cc1ccccc1)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2573 |
| logD: | 2.2572 |
| logSw: | -3.0044 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.592 |
| InChI Key: | MIIQECBLORHCBT-UHFFFAOYSA-N |