1-{5-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-(2,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
Chemical Structure Depiction of
1-{5-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-(2,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
1-{5-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-(2,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | F076-1216 |
| Compound Name: | 1-{5-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-(2,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C20 H26 N4 O5 |
| Smiles: | CC(N1C(c2cc(c(cc2OC)OC)OC)OC(CCc2c(C)n[nH]c2C)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2515 |
| logD: | 2.251 |
| logSw: | -2.5372 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.204 |
| InChI Key: | HHCQLTDKYYMFOE-FQEVSTJZSA-N |