4-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-(3,4-dimethylphenyl)isoquinolin-1(2H)-one
Chemical Structure Depiction of
4-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-(3,4-dimethylphenyl)isoquinolin-1(2H)-one
4-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-(3,4-dimethylphenyl)isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | F982-0697 |
| Compound Name: | 4-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-(3,4-dimethylphenyl)isoquinolin-1(2H)-one |
| Molecular Weight: | 472.34 |
| Molecular Formula: | C25 H18 Br N3 O2 |
| Smiles: | Cc1ccc(cc1C)N1C=C(c2ccccc2C1=O)c1nc(c2ccc(cc2)[Br])no1 |
| Stereo: | ACHIRAL |
| logP: | 6.4695 |
| logD: | 6.4695 |
| logSw: | -5.6177 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.16 |
| InChI Key: | BBZQDEYNLQVJAW-UHFFFAOYSA-N |