2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(2-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(2-fluorophenyl)acetamide
2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(2-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | E196-0029 |
| Compound Name: | 2-[(3-benzyl-4-oxo-3,4-dihydropteridin-2-yl)sulfanyl]-N-(2-fluorophenyl)acetamide |
| Molecular Weight: | 421.45 |
| Molecular Formula: | C21 H16 F N5 O2 S |
| Smiles: | C(c1ccccc1)N1C(=Nc2c(C1=O)nccn2)SCC(Nc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8475 |
| logD: | 2.8474 |
| logSw: | -3.2636 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.755 |
| InChI Key: | LQGYHTZUHKBHFH-UHFFFAOYSA-N |