N-{[(2,3-dihydro-1,4-benzodioxin-6-yl)amino][(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]methylidene}benzamide
Chemical Structure Depiction of
N-{[(2,3-dihydro-1,4-benzodioxin-6-yl)amino][(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]methylidene}benzamide
N-{[(2,3-dihydro-1,4-benzodioxin-6-yl)amino][(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]methylidene}benzamide
Compound characteristics
| Compound ID: | Y021-2057 |
| Compound Name: | N-{[(2,3-dihydro-1,4-benzodioxin-6-yl)amino][(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]methylidene}benzamide |
| Molecular Weight: | 433.47 |
| Molecular Formula: | C23 H23 N5 O4 |
| Smiles: | CCCC1=CC(NC(NC(/Nc2ccc3c(c2)OCCO3)=N/C(c2ccccc2)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4211 |
| logD: | 2.0125 |
| logSw: | -3.0578 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.165 |
| InChI Key: | JYPUXEFQENODGF-UHFFFAOYSA-N |