2-[(1,5,7-trimethyl-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl)methyl]benzonitrile
Chemical Structure Depiction of
2-[(1,5,7-trimethyl-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl)methyl]benzonitrile
2-[(1,5,7-trimethyl-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl)methyl]benzonitrile
Compound characteristics
| Compound ID: | J026-3533 |
| Compound Name: | 2-[(1,5,7-trimethyl-2,4-dioxo-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl)methyl]benzonitrile |
| Molecular Weight: | 320.35 |
| Molecular Formula: | C18 H16 N4 O2 |
| Smiles: | Cc1cc(C)nc2c1C(N(Cc1ccccc1C#N)C(N2C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7882 |
| logD: | 2.788 |
| logSw: | -3.1874 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.065 |
| InChI Key: | QBWNQOJDCPTSQA-UHFFFAOYSA-N |