6-({[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(oxolan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
6-({[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(oxolan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
6-({[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(oxolan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | L541-0322 |
| Compound Name: | 6-({[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-[(oxolan-2-yl)methyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 482.49 |
| Molecular Formula: | C23 H19 F N4 O5 S |
| Smiles: | C1CC(CN2C(=Nc3cc4c(cc3C2=O)OCO4)SCc2nc(c3cccc(c3)F)no2)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4455 |
| logD: | 4.4455 |
| logSw: | -4.4588 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 82.884 |
| InChI Key: | NKEVEZFRMLYDFF-OAHLLOKOSA-N |