3-nitrophenyl 2-{[(2-fluorophenyl)methyl]sulfanyl}pyridine-3-carboxylate
Chemical Structure Depiction of
3-nitrophenyl 2-{[(2-fluorophenyl)methyl]sulfanyl}pyridine-3-carboxylate
3-nitrophenyl 2-{[(2-fluorophenyl)methyl]sulfanyl}pyridine-3-carboxylate
Compound characteristics
| Compound ID: | K786-1987 |
| Compound Name: | 3-nitrophenyl 2-{[(2-fluorophenyl)methyl]sulfanyl}pyridine-3-carboxylate |
| Molecular Weight: | 384.38 |
| Molecular Formula: | C19 H13 F N2 O4 S |
| Smiles: | C(c1ccccc1F)Sc1c(cccn1)C(=O)Oc1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7527 |
| logD: | 4.7527 |
| logSw: | -4.9344 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.905 |
| InChI Key: | HMAMQRNFFQRYPR-UHFFFAOYSA-N |