N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-N'-[3-(trifluoromethyl)phenyl]urea
Chemical Structure Depiction of
N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-N'-[3-(trifluoromethyl)phenyl]urea
N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-N'-[3-(trifluoromethyl)phenyl]urea
Compound characteristics
| Compound ID: | Y206-9651 |
| Compound Name: | N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-N'-[3-(trifluoromethyl)phenyl]urea |
| Molecular Weight: | 402.42 |
| Molecular Formula: | C21 H21 F3 N4 O |
| Smiles: | Cc1ccccc1Cn1c(C)c(c(C)n1)NC(Nc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1008 |
| logD: | 5.1005 |
| logSw: | -4.9559 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.428 |
| InChI Key: | KKIASZXPNRHODC-UHFFFAOYSA-N |