N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | F414-0965 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(4-fluoroanilino)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 355.33 |
| Molecular Formula: | C17 H14 F N5 O3 |
| Smiles: | C1COc2cc(ccc2O1)NC(c1c(Nc2ccc(cc2)F)[nH]nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7052 |
| logD: | 1.6393 |
| logSw: | -2.3215 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.378 |
| InChI Key: | PQGNWDVFBRTPBV-UHFFFAOYSA-N |