6-({[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-methyl-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Chemical Structure Depiction of
6-({[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-methyl-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
6-({[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-methyl-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | L541-0204 |
| Compound Name: | 6-({[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-methyl-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 468.49 |
| Molecular Formula: | C22 H20 N4 O6 S |
| Smiles: | CCOc1ccc(cc1OC)c1nc(CSC2=Nc3cc4c(cc3C(N2C)=O)OCO4)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.9204 |
| logD: | 3.9204 |
| logSw: | -4.0276 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.107 |
| InChI Key: | HPBADFDTYUNHET-UHFFFAOYSA-N |