N-butyl-N'-{4-chloro-1-[(2-chlorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
Chemical Structure Depiction of
N-butyl-N'-{4-chloro-1-[(2-chlorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
N-butyl-N'-{4-chloro-1-[(2-chlorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
Compound characteristics
| Compound ID: | Y503-3652 |
| Compound Name: | N-butyl-N'-{4-chloro-1-[(2-chlorophenyl)methyl]-1H-pyrazol-3-yl}thiourea |
| Molecular Weight: | 357.3 |
| Molecular Formula: | C15 H18 Cl2 N4 S |
| Smiles: | CCCCNC(Nc1c(cn(Cc2ccccc2[Cl])n1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 4.3699 |
| logD: | 4.3695 |
| logSw: | -4.3422 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.418 |
| InChI Key: | ZFKUXXDDDKVEBD-UHFFFAOYSA-N |