2-ethoxy-4-(piperidine-1-carbothioyl)phenyl 4-bromobenzoate
Chemical Structure Depiction of
2-ethoxy-4-(piperidine-1-carbothioyl)phenyl 4-bromobenzoate
2-ethoxy-4-(piperidine-1-carbothioyl)phenyl 4-bromobenzoate
Compound characteristics
| Compound ID: | 8008-4590 |
| Compound Name: | 2-ethoxy-4-(piperidine-1-carbothioyl)phenyl 4-bromobenzoate |
| Molecular Weight: | 448.38 |
| Molecular Formula: | C21 H22 Br N O3 S |
| Smiles: | CCOc1cc(ccc1OC(c1ccc(cc1)[Br])=O)C(N1CCCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.4651 |
| logD: | 5.4651 |
| logSw: | -5.373 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 29.8615 |
| InChI Key: | YYGJBFADDQRFQO-UHFFFAOYSA-N |