1-[2-(2,5-difluorobenzoyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]-2-methoxyethan-1-one
Chemical Structure Depiction of
1-[2-(2,5-difluorobenzoyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]-2-methoxyethan-1-one
1-[2-(2,5-difluorobenzoyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]-2-methoxyethan-1-one
Compound characteristics
| Compound ID: | SB59-0534 |
| Compound Name: | 1-[2-(2,5-difluorobenzoyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]-2-methoxyethan-1-one |
| Molecular Weight: | 405.4 |
| Molecular Formula: | C19 H21 F2 N5 O3 |
| Smiles: | Cn1cnnc1C1CN(CC12CN(C2)C(c1cc(ccc1F)F)=O)C(COC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.1883 |
| logD: | -0.1883 |
| logSw: | -2.1261 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.774 |
| InChI Key: | MHHGSSNAGKRVST-CQSZACIVSA-N |