6-(4-bromophenyl)-2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]pyridazin-3(2H)-one
Chemical Structure Depiction of
6-(4-bromophenyl)-2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]pyridazin-3(2H)-one
6-(4-bromophenyl)-2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | Y043-1414 |
| Compound Name: | 6-(4-bromophenyl)-2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]pyridazin-3(2H)-one |
| Molecular Weight: | 429.27 |
| Molecular Formula: | C20 H17 Br N2 O4 |
| Smiles: | COc1ccc(cc1OC)C(CN1C(C=CC(c2ccc(cc2)[Br])=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6061 |
| logD: | 3.6061 |
| logSw: | -3.818 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.055 |
| InChI Key: | QNEMMQAKFKOQNS-UHFFFAOYSA-N |