2-[3-(methylsulfanyl)phenyl]-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]phthalazin-1(2H)-one
Chemical Structure Depiction of
2-[3-(methylsulfanyl)phenyl]-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]phthalazin-1(2H)-one
2-[3-(methylsulfanyl)phenyl]-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | F990-0483 |
| Compound Name: | 2-[3-(methylsulfanyl)phenyl]-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]phthalazin-1(2H)-one |
| Molecular Weight: | 413.46 |
| Molecular Formula: | C22 H15 N5 O2 S |
| Smiles: | CSc1cccc(c1)N1C(c2ccccc2C(c2nc(c3ccncc3)no2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8573 |
| logD: | 3.8545 |
| logSw: | -4.0196 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.882 |
| InChI Key: | TUZKWBLPMAZSGB-UHFFFAOYSA-N |