4-{4-[2,6-di(propan-2-yl)phenoxy]butyl}-3,5-dimethyl-1H-pyrazole
Chemical Structure Depiction of
4-{4-[2,6-di(propan-2-yl)phenoxy]butyl}-3,5-dimethyl-1H-pyrazole
4-{4-[2,6-di(propan-2-yl)phenoxy]butyl}-3,5-dimethyl-1H-pyrazole
Compound characteristics
| Compound ID: | 5813-1999 |
| Compound Name: | 4-{4-[2,6-di(propan-2-yl)phenoxy]butyl}-3,5-dimethyl-1H-pyrazole |
| Molecular Weight: | 328.5 |
| Molecular Formula: | C21 H32 N2 O |
| Smiles: | CC(C)c1cccc(C(C)C)c1OCCCCc1c(C)n[nH]c1C |
| Stereo: | ACHIRAL |
| logP: | 5.6063 |
| logD: | 5.6058 |
| logSw: | -5.3921 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.4729 |
| InChI Key: | PKJDCLNCDUROOR-UHFFFAOYSA-N |