6-(4-bromobenzene-1-sulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octane
Chemical Structure Depiction of
6-(4-bromobenzene-1-sulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octane
6-(4-bromobenzene-1-sulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octane
Compound characteristics
| Compound ID: | SD74-0033 |
| Compound Name: | 6-(4-bromobenzene-1-sulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octane |
| Molecular Weight: | 411.32 |
| Molecular Formula: | C16 H19 Br N4 O2 S |
| Smiles: | Cn1cnnc1C1CN(CC12CCC2)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1384 |
| logD: | 2.1384 |
| logSw: | -2.5915 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.346 |
| InChI Key: | IWUZYHFLNLCFBU-AWEZNQCLSA-N |