2-[(3,4-difluorophenyl)methyl]-6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octane
Chemical Structure Depiction of
2-[(3,4-difluorophenyl)methyl]-6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octane
2-[(3,4-difluorophenyl)methyl]-6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octane
Compound characteristics
Compound ID: | SB59-0176 |
Compound Name: | 2-[(3,4-difluorophenyl)methyl]-6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octane |
Molecular Weight: | 397.45 |
Molecular Formula: | C17 H21 F2 N5 O2 S |
Smiles: | Cn1cnnc1C1CN(CC12CN(Cc1ccc(c(c1)F)F)C2)S(C)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 0.4934 |
logD: | -2.2847 |
logSw: | -2.2465 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 60.517 |
InChI Key: | CWTDXFWQOJIZNL-ZDUSSCGKSA-N |