N-{4-chloro-1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(2-methoxyethyl)thiourea
Chemical Structure Depiction of
N-{4-chloro-1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(2-methoxyethyl)thiourea
N-{4-chloro-1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(2-methoxyethyl)thiourea
Compound characteristics
| Compound ID: | Y501-1542 |
| Compound Name: | N-{4-chloro-1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(2-methoxyethyl)thiourea |
| Molecular Weight: | 377.27 |
| Molecular Formula: | C14 H15 Cl2 F N4 O S |
| Smiles: | COCCNC(Nc1c(cn(Cc2c(cccc2[Cl])F)n1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 3.0418 |
| logD: | 3.0413 |
| logSw: | -3.5697 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.76 |
| InChI Key: | NABPORLRWPPMHR-UHFFFAOYSA-N |