2-(3-chlorophenyl)-4-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}phthalazin-1(2H)-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-4-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}phthalazin-1(2H)-one
2-(3-chlorophenyl)-4-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}phthalazin-1(2H)-one
Compound characteristics
| Compound ID: | F990-0244 |
| Compound Name: | 2-(3-chlorophenyl)-4-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}phthalazin-1(2H)-one |
| Molecular Weight: | 446.91 |
| Molecular Formula: | C23 H15 Cl N4 O2 S |
| Smiles: | CSc1ccc(cc1)c1nc(C2c3ccccc3C(N(c3cccc(c3)[Cl])N=2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 6.0369 |
| logD: | 6.0361 |
| logSw: | -6.0166 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.453 |
| InChI Key: | IIELWRGYRQNFBD-UHFFFAOYSA-N |