N-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
N-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D296-0050F |
| Compound Name: | N-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 382.37 |
| Molecular Formula: | C19 H18 N4 O5 |
| Smiles: | COc1ccc(cc1)n1cc(C(NCCOc2ccc3c(c2)OCO3)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.7248 |
| logD: | 2.7248 |
| logSw: | -3.2551 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.935 |
| InChI Key: | IQAPHDOJOVFZPO-UHFFFAOYSA-N |