N-(2,4-dimethoxyphenyl)-2-{7-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6,8-dioxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}acetamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-2-{7-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6,8-dioxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}acetamide
N-(2,4-dimethoxyphenyl)-2-{7-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6,8-dioxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}acetamide
Compound characteristics
| Compound ID: | E843-0022 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-2-{7-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6,8-dioxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}acetamide |
| Molecular Weight: | 495.45 |
| Molecular Formula: | C23 H21 N5 O8 |
| Smiles: | Cc1nc(CN2C(c3cc4c(cc3N(CC(Nc3ccc(cc3OC)OC)=O)C2=O)OCO4)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.371 |
| logD: | 2.3709 |
| logSw: | -3.1529 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.235 |
| InChI Key: | UTHQVJCGUVCXDL-UHFFFAOYSA-N |