N-(3-fluorophenyl)-2-{[4-hydroxy-6-oxo-5-(3-phenylprop-2-en-1-yl)-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-2-{[4-hydroxy-6-oxo-5-(3-phenylprop-2-en-1-yl)-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
N-(3-fluorophenyl)-2-{[4-hydroxy-6-oxo-5-(3-phenylprop-2-en-1-yl)-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 5210-2219 |
| Compound Name: | N-(3-fluorophenyl)-2-{[4-hydroxy-6-oxo-5-(3-phenylprop-2-en-1-yl)-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 411.45 |
| Molecular Formula: | C21 H18 F N3 O3 S |
| Smiles: | [H]N1C(=NC(=C(C/C=C/c2ccccc2)C1=O)O)SCC(Nc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4477 |
| logD: | -0.1118 |
| logSw: | -3.7997 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.55 |
| InChI Key: | XTXISQHVGXKCQH-UHFFFAOYSA-N |