(isoquinolin-1-yl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
Chemical Structure Depiction of
(isoquinolin-1-yl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
(isoquinolin-1-yl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
Compound characteristics
| Compound ID: | SC69-0040 |
| Compound Name: | (isoquinolin-1-yl)[4-(4-methyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonan-2-yl]methanone |
| Molecular Weight: | 361.45 |
| Molecular Formula: | C21 H23 N5 O |
| Smiles: | Cn1cnnc1C1CN(CC12CCCC2)C(c1c2ccccc2ccn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.707 |
| logD: | 1.707 |
| logSw: | -2.2397 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.865 |
| InChI Key: | WQTMNYGAIXEOAB-KRWDZBQOSA-N |