N-butyl-N'-{1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}urea
Chemical Structure Depiction of
N-butyl-N'-{1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}urea
N-butyl-N'-{1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}urea
Compound characteristics
| Compound ID: | Y206-9571 |
| Compound Name: | N-butyl-N'-{1-[(2-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}urea |
| Molecular Weight: | 318.39 |
| Molecular Formula: | C17 H23 F N4 O |
| Smiles: | CCCCNC(Nc1c(C)nn(Cc2ccccc2F)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8503 |
| logD: | 2.8503 |
| logSw: | -3.0164 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.863 |
| InChI Key: | MCMTVECRAUMSBA-UHFFFAOYSA-N |