[5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]{3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone
Chemical Structure Depiction of
[5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]{3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone
[5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]{3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone
Compound characteristics
| Compound ID: | T501-1417 |
| Compound Name: | [5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]{3-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}methanone |
| Molecular Weight: | 459.55 |
| Molecular Formula: | C25 H29 N7 O2 |
| Smiles: | CCn1c(C)c(c(C)n1)c1cc(C(N2CCCC(Cc3nncn3c3ccccc3)C2)=O)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5039 |
| logD: | 2.5038 |
| logSw: | -2.6985 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 78.154 |
| InChI Key: | HKGCBLUCQUKAGT-LJQANCHMSA-N |