[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]{4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methanone
Chemical Structure Depiction of
[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]{4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methanone
[3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]{4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methanone
Compound characteristics
| Compound ID: | SC42-0112 |
| Compound Name: | [3-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]{4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}methanone |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C25 H31 N5 O3 |
| Smiles: | Cc1ccc(cc1C)c1cc(C(N2CCC3(CC2)CC(CCO3)Cc2nc(C)on2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.369 |
| logD: | 4.3685 |
| logSw: | -4.2837 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.874 |
| InChI Key: | ZNJOHHFCUIIPNU-IBGZPJMESA-N |