N-[2-(2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)ethyl]-3-[(pyrimidin-2-yl)amino]benzamide
Chemical Structure Depiction of
N-[2-(2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)ethyl]-3-[(pyrimidin-2-yl)amino]benzamide
N-[2-(2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)ethyl]-3-[(pyrimidin-2-yl)amino]benzamide
Compound characteristics
| Compound ID: | Y041-2872 |
| Compound Name: | N-[2-(2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)ethyl]-3-[(pyrimidin-2-yl)amino]benzamide |
| Molecular Weight: | 402.41 |
| Molecular Formula: | C21 H18 N6 O3 |
| Smiles: | C(CN1C(C(Nc2ccccc12)=O)=O)NC(c1cccc(c1)Nc1ncccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.371 |
| logD: | 1.3383 |
| logSw: | -2.0419 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.285 |
| InChI Key: | VPNKPZYUDUFTJP-UHFFFAOYSA-N |