N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N'-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea
Chemical Structure Depiction of
N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N'-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea
N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N'-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea
Compound characteristics
| Compound ID: | Y502-7456 |
| Compound Name: | N-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N'-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea |
| Molecular Weight: | 388.92 |
| Molecular Formula: | C18 H21 Cl N6 S |
| Smiles: | Cc1c(CNC(Nc2cnn(Cc3ccc(cc3)[Cl])c2)=S)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.2353 |
| logD: | 2.2353 |
| logSw: | -3.0158 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.728 |
| InChI Key: | QJLPJVFPSGDRHQ-UHFFFAOYSA-N |