2-ethoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl 2-bromobenzoate
Chemical Structure Depiction of
2-ethoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl 2-bromobenzoate
2-ethoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl 2-bromobenzoate
Compound characteristics
| Compound ID: | 8009-9029 |
| Compound Name: | 2-ethoxy-4-(4-methylpiperidine-1-carbothioyl)phenyl 2-bromobenzoate |
| Molecular Weight: | 462.4 |
| Molecular Formula: | C22 H24 Br N O3 S |
| Smiles: | CCOc1cc(ccc1OC(c1ccccc1[Br])=O)C(N1CCC(C)CC1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.4723 |
| logD: | 5.4723 |
| logSw: | -5.4355 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 29.8615 |
| InChI Key: | WNQRBHHAACWYSU-UHFFFAOYSA-N |