4-[4-(2-tert-butyl-4-methylphenoxy)butyl]-3,5-dimethyl-1H-pyrazole
Chemical Structure Depiction of
4-[4-(2-tert-butyl-4-methylphenoxy)butyl]-3,5-dimethyl-1H-pyrazole
4-[4-(2-tert-butyl-4-methylphenoxy)butyl]-3,5-dimethyl-1H-pyrazole
Compound characteristics
| Compound ID: | 5813-1753 |
| Compound Name: | 4-[4-(2-tert-butyl-4-methylphenoxy)butyl]-3,5-dimethyl-1H-pyrazole |
| Molecular Weight: | 314.47 |
| Molecular Formula: | C20 H30 N2 O |
| Smiles: | Cc1ccc(c(c1)C(C)(C)C)OCCCCc1c(C)n[nH]c1C |
| Stereo: | ACHIRAL |
| logP: | 5.4281 |
| logD: | 5.4276 |
| logSw: | -5.3796 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.3863 |
| InChI Key: | YDNYMBDNCUELEI-UHFFFAOYSA-N |