7-propyl-6-[({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)sulfanyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
7-propyl-6-[({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)sulfanyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
7-propyl-6-[({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)sulfanyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | L541-0060 |
| Compound Name: | 7-propyl-6-[({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)sulfanyl]-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 490.46 |
| Molecular Formula: | C22 H17 F3 N4 O4 S |
| Smiles: | CCCN1C(=Nc2cc3c(cc2C1=O)OCO3)SCc1nc(c2ccc(cc2)C(F)(F)F)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.9418 |
| logD: | 5.9418 |
| logSw: | -5.5509 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.479 |
| InChI Key: | XOHOVHQIIMNJBK-UHFFFAOYSA-N |