6,7-diethoxy-3-{[4-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)phenyl]methyl}quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
6,7-diethoxy-3-{[4-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)phenyl]methyl}quinazoline-2,4(1H,3H)-dione
6,7-diethoxy-3-{[4-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)phenyl]methyl}quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | K221-3027 |
| Compound Name: | 6,7-diethoxy-3-{[4-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)phenyl]methyl}quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 525.6 |
| Molecular Formula: | C31 H31 N3 O5 |
| Smiles: | CCOc1cc2C(N(Cc3ccc(cc3)C(N3CCC(=CC3)c3ccccc3)=O)C(Nc2cc1OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3637 |
| logD: | 4.3585 |
| logSw: | -4.1411 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.277 |
| InChI Key: | ZBUJJNOZBWYNJW-UHFFFAOYSA-N |