methyl 3-{[3,5-bis(4-bromophenyl)-1H-pyrazol-1-yl]methyl}benzoate
Chemical Structure Depiction of
methyl 3-{[3,5-bis(4-bromophenyl)-1H-pyrazol-1-yl]methyl}benzoate
methyl 3-{[3,5-bis(4-bromophenyl)-1H-pyrazol-1-yl]methyl}benzoate
Compound characteristics
| Compound ID: | Y505-5533 |
| Compound Name: | methyl 3-{[3,5-bis(4-bromophenyl)-1H-pyrazol-1-yl]methyl}benzoate |
| Molecular Weight: | 526.23 |
| Molecular Formula: | C24 H18 Br2 N2 O2 |
| Smiles: | COC(c1cccc(Cn2c(cc(c3ccc(cc3)[Br])n2)c2ccc(cc2)[Br])c1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4929 |
| logD: | 7.4929 |
| logSw: | -5.7483 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.827 |
| InChI Key: | AHXGQZKJJBOQCD-UHFFFAOYSA-N |