3-(1H-tetrazol-1-yl)phenyl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
3-(1H-tetrazol-1-yl)phenyl 3,4,5-trimethoxybenzoate
3-(1H-tetrazol-1-yl)phenyl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | D453-0663 |
| Compound Name: | 3-(1H-tetrazol-1-yl)phenyl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 356.34 |
| Molecular Formula: | C17 H16 N4 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)C(=O)Oc1cccc(c1)n1cnnn1 |
| Stereo: | ACHIRAL |
| logP: | 1.9425 |
| logD: | 1.9425 |
| logSw: | -2.6116 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.359 |
| InChI Key: | KNVHBKBVXVYLGW-UHFFFAOYSA-N |