N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4H-1,2,4-triazol-4-yl)pyridine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4H-1,2,4-triazol-4-yl)pyridine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4H-1,2,4-triazol-4-yl)pyridine-4-carboxamide
Compound characteristics
| Compound ID: | 8018-7383 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4H-1,2,4-triazol-4-yl)pyridine-4-carboxamide |
| Molecular Weight: | 323.31 |
| Molecular Formula: | C16 H13 N5 O3 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1ccnc(c1)n1cnnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3047 |
| logD: | 1.2822 |
| logSw: | -1.948 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.31 |
| InChI Key: | GAWAYOMEMUHKIV-UHFFFAOYSA-N |