1-[6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-(thiophen-3-yl)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-(thiophen-3-yl)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-(thiophen-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | SB59-0116 |
| Compound Name: | 1-[6-(methanesulfonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-(thiophen-3-yl)ethan-1-one |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C16 H21 N5 O3 S2 |
| Smiles: | Cn1cnnc1C1CN(CC12CN(C2)C(Cc1ccsc1)=O)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.2231 |
| logD: | -0.2231 |
| logSw: | -2.0073 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.924 |
| InChI Key: | NEJODKDZSPXYDV-ZDUSSCGKSA-N |