N-{2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]ethyl}-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-{2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]ethyl}-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
N-{2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]ethyl}-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D296-0038 |
| Compound Name: | N-{2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]ethyl}-1-(4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C22 H24 N4 O4 |
| Smiles: | CC1(C)Cc2cccc(c2O1)OCCNC(c1cn(c2ccc(cc2)OC)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6291 |
| logD: | 3.6291 |
| logSw: | -3.9282 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.29 |
| InChI Key: | PGRQMTSASXGGRK-UHFFFAOYSA-N |