N-[2-(3,4-dimethoxyphenyl)ethyl]-5-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
Compound characteristics
| Compound ID: | C260-1442 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-5-{2,4-dioxo-1-[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,4-dihydroquinazolin-3(2H)-yl}pentanamide |
| Molecular Weight: | 583.64 |
| Molecular Formula: | C32 H33 N5 O6 |
| Smiles: | COc1ccc(CCNC(CCCCN2C(c3ccccc3N(CC3=CC(N4C=CC=CC4=N3)=O)C2=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.3333 |
| logD: | 1.3333 |
| logSw: | -2.4877 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.806 |
| InChI Key: | OKCSMTVHAFDYEY-UHFFFAOYSA-N |