1-[6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-(4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-(4-methoxyphenyl)ethan-1-one
1-[6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-(4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | SB59-0189 |
| Compound Name: | 1-[6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-(4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C19 H25 N5 O4 S |
| Smiles: | Cn1cnnc1C1CN(CC12CN(C2)C(Cc1ccc(cc1)OC)=O)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.0078 |
| logD: | 0.0078 |
| logSw: | -2.1213 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.449 |
| InChI Key: | RKIPNSSQJVRFBT-INIZCTEOSA-N |