4-bromo-2-(piperidine-1-carbothioyl)phenyl 2-chlorobenzoate
Chemical Structure Depiction of
4-bromo-2-(piperidine-1-carbothioyl)phenyl 2-chlorobenzoate
4-bromo-2-(piperidine-1-carbothioyl)phenyl 2-chlorobenzoate
Compound characteristics
| Compound ID: | 3405-0100 |
| Compound Name: | 4-bromo-2-(piperidine-1-carbothioyl)phenyl 2-chlorobenzoate |
| Molecular Weight: | 438.77 |
| Molecular Formula: | C19 H17 Br Cl N O2 S |
| Smiles: | C1CCN(CC1)C(c1cc(ccc1OC(c1ccccc1[Cl])=O)[Br])=S |
| Stereo: | ACHIRAL |
| logP: | 6.0555 |
| logD: | 6.0555 |
| logSw: | -6.0416 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 22.6513 |
| InChI Key: | HYFQXPOIAUFGGM-UHFFFAOYSA-N |