4-bromo-2-(morpholine-4-carbothioyl)phenyl benzoate
Chemical Structure Depiction of
4-bromo-2-(morpholine-4-carbothioyl)phenyl benzoate
4-bromo-2-(morpholine-4-carbothioyl)phenyl benzoate
Compound characteristics
Compound ID: | 3405-0086 |
Compound Name: | 4-bromo-2-(morpholine-4-carbothioyl)phenyl benzoate |
Molecular Weight: | 406.3 |
Molecular Formula: | C18 H16 Br N O3 S |
Smiles: | C1COCCN1C(c1cc(ccc1OC(c1ccccc1)=O)[Br])=S |
Stereo: | ACHIRAL |
logP: | 4.0579 |
logD: | 4.0579 |
logSw: | -4.2159 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 30.5598 |
InChI Key: | ACVFRZCDKFKNMU-UHFFFAOYSA-N |