2-ethyl-1-[4-(3-propyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]butan-1-one
Chemical Structure Depiction of
2-ethyl-1-[4-(3-propyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]butan-1-one
2-ethyl-1-[4-(3-propyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]butan-1-one
Compound characteristics
| Compound ID: | SC46-0342 |
| Compound Name: | 2-ethyl-1-[4-(3-propyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]butan-1-one |
| Molecular Weight: | 332.49 |
| Molecular Formula: | C19 H32 N4 O |
| Smiles: | CCCc1nc(C2CN(CC23CCCC3)C(C(CC)CC)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6751 |
| logD: | 3.6727 |
| logSw: | -3.6964 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.453 |
| InChI Key: | YXUMRUVLKWQKLW-HNNXBMFYSA-N |