N-benzyl-N'-{1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
Chemical Structure Depiction of
N-benzyl-N'-{1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
N-benzyl-N'-{1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
Compound characteristics
| Compound ID: | Y500-4670 |
| Compound Name: | N-benzyl-N'-{1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}thiourea |
| Molecular Weight: | 391.32 |
| Molecular Formula: | C18 H16 Cl2 N4 S |
| Smiles: | C(c1ccccc1)NC(Nc1ccn(Cc2ccc(c(c2)[Cl])[Cl])n1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.4309 |
| logD: | 4.4307 |
| logSw: | -4.5803 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.339 |
| InChI Key: | KYXFSMVITPOEDT-UHFFFAOYSA-N |