1-[(2-chloro-4-fluorophenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methyl-1H-pyrazole
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methyl-1H-pyrazole
1-[(2-chloro-4-fluorophenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methyl-1H-pyrazole
Compound characteristics
| Compound ID: | Y505-5679 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methyl-1H-pyrazole |
| Molecular Weight: | 496.97 |
| Molecular Formula: | C27 H26 Cl F N2 O4 |
| Smiles: | Cc1c(c2ccc(c(c2)OC)OC)nn(Cc2ccc(cc2[Cl])F)c1c1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.7182 |
| logD: | 5.7182 |
| logSw: | -6.0879 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.722 |
| InChI Key: | KXOUGJQMHQYRHZ-UHFFFAOYSA-N |