N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N'-(1-ethyl-5-methyl-1H-pyrazol-4-yl)thiourea
Chemical Structure Depiction of
N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N'-(1-ethyl-5-methyl-1H-pyrazol-4-yl)thiourea
N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N'-(1-ethyl-5-methyl-1H-pyrazol-4-yl)thiourea
Compound characteristics
| Compound ID: | Y502-6890 |
| Compound Name: | N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N'-(1-ethyl-5-methyl-1H-pyrazol-4-yl)thiourea |
| Molecular Weight: | 374.89 |
| Molecular Formula: | C17 H19 Cl N6 S |
| Smiles: | CCn1c(C)c(cn1)NC(Nc1cnn(Cc2ccc(cc2)[Cl])c1)=S |
| Stereo: | ACHIRAL |
| logP: | 2.924 |
| logD: | 2.924 |
| logSw: | -3.4783 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.794 |
| InChI Key: | HQMUOZWBBFVKHE-UHFFFAOYSA-N |