4-[(2-bromophenoxy)methyl]-N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}benzamide
Chemical Structure Depiction of
4-[(2-bromophenoxy)methyl]-N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}benzamide
4-[(2-bromophenoxy)methyl]-N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}benzamide
Compound characteristics
| Compound ID: | Y501-4514 |
| Compound Name: | 4-[(2-bromophenoxy)methyl]-N-{3,5-dimethyl-1-[(pentafluorophenyl)methyl]-1H-pyrazol-4-yl}benzamide |
| Molecular Weight: | 580.35 |
| Molecular Formula: | C26 H19 Br F5 N3 O2 |
| Smiles: | Cc1c(c(C)n(Cc2c(c(c(c(c2F)F)F)F)F)n1)NC(c1ccc(COc2ccccc2[Br])cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4361 |
| logD: | 5.4332 |
| logSw: | -5.5618 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.53 |
| InChI Key: | RKNRYKQNCAJOAP-UHFFFAOYSA-N |