N-butyl-N'-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}thiourea
Chemical Structure Depiction of
N-butyl-N'-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}thiourea
N-butyl-N'-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}thiourea
Compound characteristics
| Compound ID: | Y502-7452 |
| Compound Name: | N-butyl-N'-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}thiourea |
| Molecular Weight: | 330.49 |
| Molecular Formula: | C18 H26 N4 S |
| Smiles: | CCCCNC(Nc1c(C)nn(Cc2ccccc2C)c1C)=S |
| Stereo: | ACHIRAL |
| logP: | 3.6331 |
| logD: | 3.6331 |
| logSw: | -3.6463 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 33.382 |
| InChI Key: | NRENRFXMAYZLCS-UHFFFAOYSA-N |