3-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
3-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | C260-1286 |
| Compound Name: | 3-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide |
| Molecular Weight: | 512.57 |
| Molecular Formula: | C29 H28 N4 O5 |
| Smiles: | COc1ccc(CCNC(CCN2C(c3ccccc3N(Cc3ccccc3C#N)C2=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.4689 |
| logD: | 2.4689 |
| logSw: | -2.9884 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.875 |
| InChI Key: | HHKBKHFJMGTJRY-UHFFFAOYSA-N |