2-methylpropyl 4-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate
Chemical Structure Depiction of
2-methylpropyl 4-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate
2-methylpropyl 4-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate
Compound characteristics
| Compound ID: | D083-0035 |
| Compound Name: | 2-methylpropyl 4-[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)amino]benzoate |
| Molecular Weight: | 329.4 |
| Molecular Formula: | C18 H23 N3 O3 |
| Smiles: | CCCC1=CC(NC(Nc2ccc(cc2)C(=O)OCC(C)C)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0707 |
| logD: | 4.0368 |
| logSw: | -4.1061 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.093 |
| InChI Key: | XGXFEXHWGQUZIV-UHFFFAOYSA-N |