N-(butan-2-yl)-N'-(3,5-dimethyl-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazol-4-yl)thiourea
Chemical Structure Depiction of
N-(butan-2-yl)-N'-(3,5-dimethyl-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazol-4-yl)thiourea
N-(butan-2-yl)-N'-(3,5-dimethyl-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazol-4-yl)thiourea
Compound characteristics
| Compound ID: | Y503-3646 |
| Compound Name: | N-(butan-2-yl)-N'-(3,5-dimethyl-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazol-4-yl)thiourea |
| Molecular Weight: | 384.47 |
| Molecular Formula: | C18 H23 F3 N4 S |
| Smiles: | CCC(C)NC(Nc1c(C)nn(Cc2cccc(c2)C(F)(F)F)c1C)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4709 |
| logD: | 3.4709 |
| logSw: | -3.7534 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 32.982 |
| InChI Key: | QJQAUZRZPPLXNL-NSHDSACASA-N |