N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{[4-(propan-2-yl)-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-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-carboxamide
Compound characteristics
| Compound ID: | S517-0671 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidine-1-carboxamide |
| Molecular Weight: | 385.46 |
| Molecular Formula: | C20 H27 N5 O3 |
| Smiles: | CC(C)n1cnnc1CC1CCN(CC1)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6279 |
| logD: | 1.6151 |
| logSw: | -2.2266 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.654 |
| InChI Key: | AEXWCTNLWVQWCM-UHFFFAOYSA-N |