2-{[4-(4-fluorophenyl)pyrimidin-2-yl]sulfanyl}-N-(3-nitrophenyl)acetamide
Chemical Structure Depiction of
2-{[4-(4-fluorophenyl)pyrimidin-2-yl]sulfanyl}-N-(3-nitrophenyl)acetamide
2-{[4-(4-fluorophenyl)pyrimidin-2-yl]sulfanyl}-N-(3-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | Y502-7660 |
| Compound Name: | 2-{[4-(4-fluorophenyl)pyrimidin-2-yl]sulfanyl}-N-(3-nitrophenyl)acetamide |
| Molecular Weight: | 384.39 |
| Molecular Formula: | C18 H13 F N4 O3 S |
| Smiles: | C(C(Nc1cccc(c1)[N+]([O-])=O)=O)Sc1nccc(c2ccc(cc2)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2705 |
| logD: | 4.2699 |
| logSw: | -4.4848 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.951 |
| InChI Key: | AGIKROPJEMJOAL-UHFFFAOYSA-N |