(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | L867-0305 |
| Compound Name: | (4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 451.48 |
| Molecular Formula: | C27 H21 N3 O4 |
| Smiles: | CCc1ccc(cc1)N1C=C(C(=O)OCC2=CC(N3C=CC=CC3=N2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.0546 |
| logD: | 3.0546 |
| logSw: | -3.4507 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.599 |
| InChI Key: | LEDZAZKTBYPLJB-UHFFFAOYSA-N |