N~3~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-[(pyridin-4-yl)methyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-[(pyridin-4-yl)methyl]-beta-alaninamide
N~3~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-[(pyridin-4-yl)methyl]-beta-alaninamide
Compound characteristics
| Compound ID: | Y044-0428 |
| Compound Name: | N~3~-[(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetyl]-N-[(pyridin-4-yl)methyl]-beta-alaninamide |
| Molecular Weight: | 425.44 |
| Molecular Formula: | C21 H23 N5 O5 |
| Smiles: | COc1cc2C(N(CC(NCCC(NCc3ccncc3)=O)=O)C=Nc2cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | -0.9014 |
| logD: | -0.9047 |
| logSw: | -1.8049 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.812 |
| InChI Key: | MLXQARHRKYNZFG-UHFFFAOYSA-N |