2-[(5-bromo-2-fluorophenyl)methyl]-4-(4-methyl-4H-1,2,4-triazol-3-yl)-8-oxa-2-azaspiro[4.5]decane
Chemical Structure Depiction of
2-[(5-bromo-2-fluorophenyl)methyl]-4-(4-methyl-4H-1,2,4-triazol-3-yl)-8-oxa-2-azaspiro[4.5]decane
2-[(5-bromo-2-fluorophenyl)methyl]-4-(4-methyl-4H-1,2,4-triazol-3-yl)-8-oxa-2-azaspiro[4.5]decane
Compound characteristics
| Compound ID: | SC66-0040 |
| Compound Name: | 2-[(5-bromo-2-fluorophenyl)methyl]-4-(4-methyl-4H-1,2,4-triazol-3-yl)-8-oxa-2-azaspiro[4.5]decane |
| Molecular Weight: | 409.3 |
| Molecular Formula: | C18 H22 Br F N4 O |
| Smiles: | Cn1cnnc1C1CN(Cc2cc(ccc2F)[Br])CC12CCOCC2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3364 |
| logD: | 0.757 |
| logSw: | -2.6286 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.945 |
| InChI Key: | PXFRPLGATFBUDP-HNNXBMFYSA-N |