6-({[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-(3-methylphenyl)-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-(3-methylphenyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
6-({[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-(3-methylphenyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | L541-0759 |
| Compound Name: | 6-({[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-(3-methylphenyl)-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 488.5 |
| Molecular Formula: | C25 H17 F N4 O4 S |
| Smiles: | Cc1cccc(c1)N1C(=Nc2cc3c(cc2C1=O)OCO3)SCc1nc(c2cccc(c2)F)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.9099 |
| logD: | 5.9086 |
| logSw: | -5.5692 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.618 |
| InChI Key: | LURVMXLDLQRKSM-UHFFFAOYSA-N |