N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carboxamide
Compound characteristics
| Compound ID: | S517-0321 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-carboxamide |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C23 H25 N5 O3 |
| Smiles: | C1CN(CCC1Cc1nncn1c1ccccc1)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2323 |
| logD: | 2.232 |
| logSw: | -2.979 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.051 |
| InChI Key: | SSOYBGROJKNILY-UHFFFAOYSA-N |