N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}propanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}propanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}propanamide
Compound characteristics
| Compound ID: | C260-1287 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{1-[(4-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}propanamide |
| Molecular Weight: | 532.55 |
| Molecular Formula: | C28 H28 N4 O7 |
| Smiles: | COc1ccc(CCNC(CCN2C(c3ccccc3N(Cc3ccc(cc3)[N+]([O-])=O)C2=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.7292 |
| logD: | 2.7292 |
| logSw: | -3.5347 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.201 |
| InChI Key: | YYCANARVVWMHPB-UHFFFAOYSA-N |