3-(1H-tetrazol-1-yl)phenyl [5-methyl-2-(propan-2-yl)phenoxy]acetate
Chemical Structure Depiction of
3-(1H-tetrazol-1-yl)phenyl [5-methyl-2-(propan-2-yl)phenoxy]acetate
3-(1H-tetrazol-1-yl)phenyl [5-methyl-2-(propan-2-yl)phenoxy]acetate
Compound characteristics
| Compound ID: | D453-0708 |
| Compound Name: | 3-(1H-tetrazol-1-yl)phenyl [5-methyl-2-(propan-2-yl)phenoxy]acetate |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C19 H20 N4 O3 |
| Smiles: | CC(C)c1ccc(C)cc1OCC(=O)Oc1cccc(c1)n1cnnn1 |
| Stereo: | ACHIRAL |
| logP: | 3.9981 |
| logD: | 3.9981 |
| logSw: | -4.1742 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.372 |
| InChI Key: | MNIFTOLFFUUHOO-UHFFFAOYSA-N |