ethyl 2,5,6-trichloro-4-[(pyrrolidine-1-carbothioyl)sulfanyl]pyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 2,5,6-trichloro-4-[(pyrrolidine-1-carbothioyl)sulfanyl]pyridine-3-carboxylate
ethyl 2,5,6-trichloro-4-[(pyrrolidine-1-carbothioyl)sulfanyl]pyridine-3-carboxylate
Compound characteristics
| Compound ID: | 8012-6790 |
| Compound Name: | ethyl 2,5,6-trichloro-4-[(pyrrolidine-1-carbothioyl)sulfanyl]pyridine-3-carboxylate |
| Molecular Weight: | 399.74 |
| Molecular Formula: | C13 H13 Cl3 N2 O2 S2 |
| Smiles: | CCOC(c1c(c(c(nc1[Cl])[Cl])[Cl])SC(N1CCCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.491 |
| logD: | 4.491 |
| logSw: | -4.9484 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 34.069 |
| InChI Key: | HAEVXMHZRYKDIX-UHFFFAOYSA-N |