4-(1H-tetrazol-1-yl)phenyl 2-butoxybenzoate
Chemical Structure Depiction of
4-(1H-tetrazol-1-yl)phenyl 2-butoxybenzoate
4-(1H-tetrazol-1-yl)phenyl 2-butoxybenzoate
Compound characteristics
| Compound ID: | D453-0623 |
| Compound Name: | 4-(1H-tetrazol-1-yl)phenyl 2-butoxybenzoate |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C18 H18 N4 O3 |
| Smiles: | CCCCOc1ccccc1C(=O)Oc1ccc(cc1)n1cnnn1 |
| Stereo: | ACHIRAL |
| logP: | 4.2107 |
| logD: | 4.2107 |
| logSw: | -4.4178 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.886 |
| InChI Key: | SWNUPGQVEDEPFH-UHFFFAOYSA-N |