4-({[4-(3-bromophenyl)-3-methyl-1-phenyl-1H-pyrazol-5-yl]imino}methyl)phenyl benzoate
Chemical Structure Depiction of
4-({[4-(3-bromophenyl)-3-methyl-1-phenyl-1H-pyrazol-5-yl]imino}methyl)phenyl benzoate
4-({[4-(3-bromophenyl)-3-methyl-1-phenyl-1H-pyrazol-5-yl]imino}methyl)phenyl benzoate
Compound characteristics
| Compound ID: | 8003-5090 |
| Compound Name: | 4-({[4-(3-bromophenyl)-3-methyl-1-phenyl-1H-pyrazol-5-yl]imino}methyl)phenyl benzoate |
| Molecular Weight: | 536.43 |
| Molecular Formula: | C30 H22 Br N3 O2 |
| Smiles: | Cc1c(c2cccc(c2)[Br])c(/N=C/c2ccc(cc2)OC(c2ccccc2)=O)n(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.7551 |
| logD: | 6.7551 |
| logSw: | -5.8925 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.562 |
| InChI Key: | TVFPRUPXFLZCCA-UHFFFAOYSA-N |