7-methyl-6-{[(3-{4-[(propan-2-yl)oxy]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-methyl-6-{[(3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
7-methyl-6-{[(3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one
Compound characteristics
| Compound ID: | L541-0195 |
| Compound Name: | 7-methyl-6-{[(3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}-2H-[1,3]dioxolo[4,5-g]quinazolin-8(7H)-one |
| Molecular Weight: | 452.49 |
| Molecular Formula: | C22 H20 N4 O5 S |
| Smiles: | CC(C)Oc1ccc(cc1)c1nc(CSC2=Nc3cc4c(cc3C(N2C)=O)OCO4)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.6188 |
| logD: | 4.6188 |
| logSw: | -4.4464 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.069 |
| InChI Key: | MRXWNWHUXJOTES-UHFFFAOYSA-N |