methyl 3-{[4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1H-pyrazol-1-yl]methyl}benzoate
Chemical Structure Depiction of
methyl 3-{[4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1H-pyrazol-1-yl]methyl}benzoate
methyl 3-{[4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1H-pyrazol-1-yl]methyl}benzoate
Compound characteristics
| Compound ID: | Y505-5514 |
| Compound Name: | methyl 3-{[4-chloro-3,5-bis(3,4-dimethoxyphenyl)-1H-pyrazol-1-yl]methyl}benzoate |
| Molecular Weight: | 522.99 |
| Molecular Formula: | C28 H27 Cl N2 O6 |
| Smiles: | COC(c1cccc(Cn2c(c3ccc(c(c3)OC)OC)c(c(c3ccc(c(c3)OC)OC)n2)[Cl])c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0796 |
| logD: | 5.0796 |
| logSw: | -5.5875 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.896 |
| InChI Key: | ALHRVEGPDPHMCU-UHFFFAOYSA-N |