3-(3,5-dimethoxyphenyl)-2-[(morpholin-4-yl)methyl]-6-nitroquinazolin-4(3H)-one
Chemical Structure Depiction of
3-(3,5-dimethoxyphenyl)-2-[(morpholin-4-yl)methyl]-6-nitroquinazolin-4(3H)-one
3-(3,5-dimethoxyphenyl)-2-[(morpholin-4-yl)methyl]-6-nitroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | C284-0471 |
| Compound Name: | 3-(3,5-dimethoxyphenyl)-2-[(morpholin-4-yl)methyl]-6-nitroquinazolin-4(3H)-one |
| Molecular Weight: | 426.43 |
| Molecular Formula: | C21 H22 N4 O6 |
| Smiles: | COc1cc(cc(c1)OC)N1C(CN2CCOCC2)=Nc2ccc(cc2C1=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7817 |
| logD: | 1.7817 |
| logSw: | -2.5877 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.976 |
| InChI Key: | QBRKLVYOLALRJQ-UHFFFAOYSA-N |