2-methoxy-4-(piperidine-1-carbothioyl)phenyl 4-methylbenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-4-(piperidine-1-carbothioyl)phenyl 4-methylbenzene-1-sulfonate
2-methoxy-4-(piperidine-1-carbothioyl)phenyl 4-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | 8015-1907 |
| Compound Name: | 2-methoxy-4-(piperidine-1-carbothioyl)phenyl 4-methylbenzene-1-sulfonate |
| Molecular Weight: | 405.53 |
| Molecular Formula: | C20 H23 N O4 S2 |
| Smiles: | Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1OC)C(N1CCCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.4826 |
| logD: | 4.4826 |
| logSw: | -4.2976 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 45.665 |
| InChI Key: | XMBQJBIXMQHAAR-UHFFFAOYSA-N |