4-(1H-tetrazol-1-yl)phenyl 4-propoxybenzoate
Chemical Structure Depiction of
4-(1H-tetrazol-1-yl)phenyl 4-propoxybenzoate
4-(1H-tetrazol-1-yl)phenyl 4-propoxybenzoate
Compound characteristics
| Compound ID: | D453-0580 |
| Compound Name: | 4-(1H-tetrazol-1-yl)phenyl 4-propoxybenzoate |
| Molecular Weight: | 324.34 |
| Molecular Formula: | C17 H16 N4 O3 |
| Smiles: | CCCOc1ccc(cc1)C(=O)Oc1ccc(cc1)n1cnnn1 |
| Stereo: | ACHIRAL |
| logP: | 3.5066 |
| logD: | 3.5066 |
| logSw: | -3.5132 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.799 |
| InChI Key: | JDHNMBGLDKLTIQ-UHFFFAOYSA-N |