1-[6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-methoxyethan-1-one
Chemical Structure Depiction of
1-[6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-methoxyethan-1-one
1-[6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-methoxyethan-1-one
Compound characteristics
| Compound ID: | SC55-1101 |
| Compound Name: | 1-[6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]-2-methoxyethan-1-one |
| Molecular Weight: | 381.48 |
| Molecular Formula: | C21 H27 N5 O2 |
| Smiles: | COCC(N1CC2(CN(CC2c2nc(C3CC3)n[nH]2)Cc2ccccc2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3833 |
| logD: | -2.9176 |
| logSw: | -1.8012 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.983 |
| InChI Key: | WTBRJPHXRSZVOJ-QGZVFWFLSA-N |