7-{[4-(4-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-8-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-6(5H)-one
Chemical Structure Depiction of
7-{[4-(4-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-8-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-6(5H)-one
7-{[4-(4-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-8-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-6(5H)-one
Compound characteristics
| Compound ID: | 6208-0374 |
| Compound Name: | 7-{[4-(4-fluorophenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-8-methyl-2H-[1,3]dioxolo[4,5-g]quinolin-6(5H)-one |
| Molecular Weight: | 478.52 |
| Molecular Formula: | C23 H15 F N4 O3 S2 |
| Smiles: | CC1=C(C(Nc2cc3c(cc12)OCO3)=O)Sc1nnc(c2cccs2)n1c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.0255 |
| logD: | 5.0254 |
| logSw: | -4.6428 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.724 |
| InChI Key: | DXCLEPYAQBGITH-UHFFFAOYSA-N |