2-methyl-1-[8-(4-methyl-4H-1,2,4-triazol-3-yl)-2-(3-phenylpropanoyl)-2,6-diazaspiro[3.4]octan-6-yl]propan-1-one
Chemical Structure Depiction of
2-methyl-1-[8-(4-methyl-4H-1,2,4-triazol-3-yl)-2-(3-phenylpropanoyl)-2,6-diazaspiro[3.4]octan-6-yl]propan-1-one
2-methyl-1-[8-(4-methyl-4H-1,2,4-triazol-3-yl)-2-(3-phenylpropanoyl)-2,6-diazaspiro[3.4]octan-6-yl]propan-1-one
Compound characteristics
| Compound ID: | SB59-0444 |
| Compound Name: | 2-methyl-1-[8-(4-methyl-4H-1,2,4-triazol-3-yl)-2-(3-phenylpropanoyl)-2,6-diazaspiro[3.4]octan-6-yl]propan-1-one |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C22 H29 N5 O2 |
| Smiles: | CC(C)C(N1CC(c2nncn2C)C2(CN(C2)C(CCc2ccccc2)=O)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3914 |
| logD: | 1.3913 |
| logSw: | -1.6905 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.35 |
| InChI Key: | NPNXOQSYXFFJCD-SFHVURJKSA-N |