methyl 3-{[4-bromo-3,5-bis(4-methylphenyl)-1H-pyrazol-1-yl]methyl}benzoate
Chemical Structure Depiction of
methyl 3-{[4-bromo-3,5-bis(4-methylphenyl)-1H-pyrazol-1-yl]methyl}benzoate
methyl 3-{[4-bromo-3,5-bis(4-methylphenyl)-1H-pyrazol-1-yl]methyl}benzoate
Compound characteristics
| Compound ID: | Y505-5598 |
| Compound Name: | methyl 3-{[4-bromo-3,5-bis(4-methylphenyl)-1H-pyrazol-1-yl]methyl}benzoate |
| Molecular Weight: | 475.38 |
| Molecular Formula: | C26 H23 Br N2 O2 |
| Smiles: | Cc1ccc(cc1)c1c(c(c2ccc(C)cc2)n(Cc2cccc(c2)C(=O)OC)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.5542 |
| logD: | 6.5542 |
| logSw: | -5.6714 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.374 |
| InChI Key: | UFLCFCXZYHXLJP-UHFFFAOYSA-N |