1-[2-(4-fluoro-3-methylbenzene-1-sulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]ethan-1-one
Chemical Structure Depiction of
1-[2-(4-fluoro-3-methylbenzene-1-sulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]ethan-1-one
1-[2-(4-fluoro-3-methylbenzene-1-sulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]ethan-1-one
Compound characteristics
| Compound ID: | SB59-0366 |
| Compound Name: | 1-[2-(4-fluoro-3-methylbenzene-1-sulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]ethan-1-one |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C18 H22 F N5 O3 S |
| Smiles: | CC(N1CC(c2nncn2C)C2(C1)CN(C2)S(c1ccc(c(C)c1)F)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5902 |
| logD: | 0.5902 |
| logSw: | -2.3485 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.408 |
| InChI Key: | FGTQIQPHJNQFPQ-OAHLLOKOSA-N |