N-(3-chloro-4-methoxyphenyl)-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-(3-chloro-4-methoxyphenyl)-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-(3-chloro-4-methoxyphenyl)-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: | E843-0023 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-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: | 499.87 |
| Molecular Formula: | C22 H18 Cl N5 O7 |
| Smiles: | Cc1nc(CN2C(c3cc4c(cc3N(CC(Nc3ccc(c(c3)[Cl])OC)=O)C2=O)OCO4)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.1364 |
| logD: | 3.1362 |
| logSw: | -3.5072 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.39 |
| InChI Key: | XOMPORYQHOOSLR-UHFFFAOYSA-N |