2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenyl 4-bromobenzoate
Chemical Structure Depiction of
2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenyl 4-bromobenzoate
2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenyl 4-bromobenzoate
Compound characteristics
| Compound ID: | 3405-0064 |
| Compound Name: | 2,6-dimethoxy-4-(morpholine-4-carbothioyl)phenyl 4-bromobenzoate |
| Molecular Weight: | 466.35 |
| Molecular Formula: | C20 H20 Br N O5 S |
| Smiles: | COc1cc(cc(c1OC(c1ccc(cc1)[Br])=O)OC)C(N1CCOCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.0286 |
| logD: | 4.0286 |
| logSw: | -4.2597 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 45.907 |
| InChI Key: | AQTNGOBPUMAHKZ-UHFFFAOYSA-N |