N-{2-[5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-[4-(trifluoromethyl)phenyl]urea
Chemical Structure Depiction of
N-{2-[5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-[4-(trifluoromethyl)phenyl]urea
N-{2-[5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-[4-(trifluoromethyl)phenyl]urea
Compound characteristics
| Compound ID: | V027-3431 |
| Compound Name: | N-{2-[5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-[4-(trifluoromethyl)phenyl]urea |
| Molecular Weight: | 602.59 |
| Molecular Formula: | C30 H30 F4 N4 O5 |
| Salt: | not_available |
| Smiles: | COCCN(CC(N1C(CC(c2ccc(cc2)F)=N1)c1ccc(c(c1)OC)OC)=O)C(Nc1ccc(cc1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0727 |
| logD: | 5.0725 |
| logSw: | -4.8562 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.472 |
| InChI Key: | DSRUBSBFQQBGAD-RUZDIDTESA-N |