3-(1H-tetrazol-1-yl)phenyl 4-[(prop-2-en-1-yl)oxy]benzoate
Chemical Structure Depiction of
3-(1H-tetrazol-1-yl)phenyl 4-[(prop-2-en-1-yl)oxy]benzoate
3-(1H-tetrazol-1-yl)phenyl 4-[(prop-2-en-1-yl)oxy]benzoate
Compound characteristics
| Compound ID: | D453-0676 |
| Compound Name: | 3-(1H-tetrazol-1-yl)phenyl 4-[(prop-2-en-1-yl)oxy]benzoate |
| Molecular Weight: | 322.32 |
| Molecular Formula: | C17 H14 N4 O3 |
| Smiles: | C=CCOc1ccc(cc1)C(=O)Oc1cccc(c1)n1cnnn1 |
| Stereo: | ACHIRAL |
| logP: | 3.0442 |
| logD: | 3.0442 |
| logSw: | -3.3901 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.799 |
| InChI Key: | LJYRXVMZMLRUAF-UHFFFAOYSA-N |