ethyl 4-(3-cyano-2,5-dioxo-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-1(5H)-yl)benzoate
Chemical Structure Depiction of
ethyl 4-(3-cyano-2,5-dioxo-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-1(5H)-yl)benzoate
ethyl 4-(3-cyano-2,5-dioxo-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-1(5H)-yl)benzoate
Compound characteristics
| Compound ID: | D021-0099 |
| Compound Name: | ethyl 4-(3-cyano-2,5-dioxo-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-1(5H)-yl)benzoate |
| Molecular Weight: | 386.37 |
| Molecular Formula: | C21 H14 N4 O4 |
| Smiles: | CCOC(c1ccc(cc1)N1C2=C(C=C(C#N)C1=O)C(N1C=CC=CC1=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0819 |
| logD: | 2.0819 |
| logSw: | -2.4511 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.772 |
| InChI Key: | UYACXKVHKSEGBS-UHFFFAOYSA-N |