(3,5-dimethylphenyl)[4-(3-ethyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
Chemical Structure Depiction of
(3,5-dimethylphenyl)[4-(3-ethyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
(3,5-dimethylphenyl)[4-(3-ethyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]methanone
Compound characteristics
| Compound ID: | SC46-0625 |
| Compound Name: | (3,5-dimethylphenyl)[4-(3-ethyl-1H-1,2,4-triazol-5-yl)-2-azaspiro[4.4]nonan-2-yl]methanone |
| Molecular Weight: | 352.48 |
| Molecular Formula: | C21 H28 N4 O |
| Smiles: | CCc1nc(C2CN(CC23CCCC3)C(c2cc(C)cc(C)c2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.379 |
| logD: | 3.3783 |
| logSw: | -3.5727 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.181 |
| InChI Key: | WSDYGNXNVWUVEL-KRWDZBQOSA-N |