2-(4-chlorophenyl)-1-[6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-1-[6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one
2-(4-chlorophenyl)-1-[6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one
Compound characteristics
| Compound ID: | SB59-0194 |
| Compound Name: | 2-(4-chlorophenyl)-1-[6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one |
| Molecular Weight: | 423.92 |
| Molecular Formula: | C18 H22 Cl N5 O3 S |
| Smiles: | Cn1cnnc1C1CN(CC12CN(C2)C(Cc1ccc(cc1)[Cl])=O)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6202 |
| logD: | 0.6201 |
| logSw: | -2.4942 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.906 |
| InChI Key: | ZAWDENQRXGEOAH-OAHLLOKOSA-N |