5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methylphenyl)-1H-tetrazole
Chemical Structure Depiction of
5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methylphenyl)-1H-tetrazole
5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methylphenyl)-1H-tetrazole
Compound characteristics
| Compound ID: | 8017-8363 |
| Compound Name: | 5-[(6-bromo-2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methylphenyl)-1H-tetrazole |
| Molecular Weight: | 373.21 |
| Molecular Formula: | C16 H13 Br N4 O2 |
| Smiles: | Cc1ccc(cc1)n1c(Cc2cc3c(cc2[Br])OCO3)nnn1 |
| Stereo: | ACHIRAL |
| logP: | 3.9004 |
| logD: | 3.9004 |
| logSw: | -3.9487 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 57.399 |
| InChI Key: | FGSMJIATCXMYAC-UHFFFAOYSA-N |