N'-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N-[(1-ethyl-1H-pyrazol-5-yl)methyl]-N-methylthiourea
Chemical Structure Depiction of
N'-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N-[(1-ethyl-1H-pyrazol-5-yl)methyl]-N-methylthiourea
N'-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N-[(1-ethyl-1H-pyrazol-5-yl)methyl]-N-methylthiourea
Compound characteristics
| Compound ID: | Y502-6387 |
| Compound Name: | N'-{1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-N-[(1-ethyl-1H-pyrazol-5-yl)methyl]-N-methylthiourea |
| Molecular Weight: | 388.92 |
| Molecular Formula: | C18 H21 Cl N6 S |
| Smiles: | CCn1c(CN(C)C(Nc2cnn(Cc3ccc(cc3)[Cl])c2)=S)ccn1 |
| Stereo: | ACHIRAL |
| logP: | 2.6117 |
| logD: | 2.6117 |
| logSw: | -3.3416 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.714 |
| InChI Key: | IJKGRMXIRQQJQY-UHFFFAOYSA-N |