3-(1H-tetrazol-1-yl)phenyl 2-bromobenzoate
Chemical Structure Depiction of
3-(1H-tetrazol-1-yl)phenyl 2-bromobenzoate
3-(1H-tetrazol-1-yl)phenyl 2-bromobenzoate
Compound characteristics
| Compound ID: | D453-0647 |
| Compound Name: | 3-(1H-tetrazol-1-yl)phenyl 2-bromobenzoate |
| Molecular Weight: | 345.15 |
| Molecular Formula: | C14 H9 Br N4 O2 |
| Smiles: | c1ccc(c(c1)C(=O)Oc1cccc(c1)n1cnnn1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.0218 |
| logD: | 3.0218 |
| logSw: | -3.6 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.382 |
| InChI Key: | YPONMUYYOFILOR-UHFFFAOYSA-N |