2-{[4-hydroxy-6-oxo-5-(3-phenylprop-2-en-1-yl)-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[4-hydroxy-6-oxo-5-(3-phenylprop-2-en-1-yl)-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
2-{[4-hydroxy-6-oxo-5-(3-phenylprop-2-en-1-yl)-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | 5210-2222 |
| Compound Name: | 2-{[4-hydroxy-6-oxo-5-(3-phenylprop-2-en-1-yl)-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C22 H21 N3 O4 S |
| Smiles: | [H]N1C(=NC(=C(C/C=C/c2ccccc2)C1=O)O)SCC(Nc1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3607 |
| logD: | -0.1987 |
| logSw: | -3.6559 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.093 |
| InChI Key: | VYAQSPDEYXDFDV-UHFFFAOYSA-N |