1-[2-(1H-indole-4-carbonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]-2-methoxyethan-1-one
Chemical Structure Depiction of
1-[2-(1H-indole-4-carbonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]-2-methoxyethan-1-one
1-[2-(1H-indole-4-carbonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]-2-methoxyethan-1-one
Compound characteristics
| Compound ID: | SB59-0514 |
| Compound Name: | 1-[2-(1H-indole-4-carbonyl)-8-(4-methyl-4H-1,2,4-triazol-3-yl)-2,6-diazaspiro[3.4]octan-6-yl]-2-methoxyethan-1-one |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C21 H24 N6 O3 |
| Smiles: | Cn1cnnc1C1CN(CC12CN(C2)C(c1cccc2c1cc[nH]2)=O)C(COC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.5283 |
| logD: | -0.5286 |
| logSw: | -2.1548 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.555 |
| InChI Key: | IEJWQATXEKQQMB-MRXNPFEDSA-N |