N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{6,8-dioxo-7-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{6,8-dioxo-7-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{6,8-dioxo-7-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}acetamide
Compound characteristics
| Compound ID: | E843-0256 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{6,8-dioxo-7-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}acetamide |
| Molecular Weight: | 585.57 |
| Molecular Formula: | C30 H27 N5 O8 |
| Smiles: | COc1ccc(CCNC(CN2C(N(Cc3nc(c4ccccc4)no3)C(c3cc4c(cc23)OCO4)=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.4961 |
| logD: | 3.4961 |
| logSw: | -3.8219 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 119.299 |
| InChI Key: | TYUCHSBSQQKCNT-UHFFFAOYSA-N |