methyl 4-{[4-ethyl-3,5-bis(4-methoxyphenyl)-1H-pyrazol-1-yl]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[4-ethyl-3,5-bis(4-methoxyphenyl)-1H-pyrazol-1-yl]methyl}benzoate
methyl 4-{[4-ethyl-3,5-bis(4-methoxyphenyl)-1H-pyrazol-1-yl]methyl}benzoate
Compound characteristics
| Compound ID: | Y505-5698 |
| Compound Name: | methyl 4-{[4-ethyl-3,5-bis(4-methoxyphenyl)-1H-pyrazol-1-yl]methyl}benzoate |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C28 H28 N2 O4 |
| Smiles: | CCc1c(c2ccc(cc2)OC)nn(Cc2ccc(cc2)C(=O)OC)c1c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.9896 |
| logD: | 5.9896 |
| logSw: | -5.5732 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.461 |
| InChI Key: | TWJARXIPGJHQLC-UHFFFAOYSA-N |