N-(butan-2-yl)-N-{[5-(dimethylamino)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N'-[4-(trifluoromethyl)phenyl]urea
Chemical Structure Depiction of
N-(butan-2-yl)-N-{[5-(dimethylamino)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N'-[4-(trifluoromethyl)phenyl]urea
N-(butan-2-yl)-N-{[5-(dimethylamino)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N'-[4-(trifluoromethyl)phenyl]urea
Compound characteristics
| Compound ID: | V029-8607 |
| Compound Name: | N-(butan-2-yl)-N-{[5-(dimethylamino)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N'-[4-(trifluoromethyl)phenyl]urea |
| Molecular Weight: | 473.54 |
| Molecular Formula: | C25 H30 F3 N5 O |
| Salt: | not_available |
| Smiles: | CCC(C)N(Cc1c(c2ccccc2)nn(C)c1N(C)C)C(Nc1ccc(cc1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4648 |
| logD: | 5.4648 |
| logSw: | -5.5152 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.97 |
| InChI Key: | QNGSKVBQDKMFPW-KRWDZBQOSA-N |