2-(4-methylphenyl)-1-[4-(3-propyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-methylphenyl)-1-[4-(3-propyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]ethan-1-one
2-(4-methylphenyl)-1-[4-(3-propyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]ethan-1-one
Compound characteristics
| Compound ID: | SC46-0341 |
| Compound Name: | 2-(4-methylphenyl)-1-[4-(3-propyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]ethan-1-one |
| Molecular Weight: | 366.51 |
| Molecular Formula: | C22 H30 N4 O |
| Smiles: | CCCc1nc(C2CN(CC23CCCC3)C(Cc2ccc(C)cc2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8761 |
| logD: | 3.8737 |
| logSw: | -3.7967 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.654 |
| InChI Key: | WLTMTJOLJWFCHX-SFHVURJKSA-N |