2-[(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)sulfanyl]ethyl hexanoate
Chemical Structure Depiction of
2-[(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)sulfanyl]ethyl hexanoate
2-[(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)sulfanyl]ethyl hexanoate
Compound characteristics
Compound ID: | Y600-1618 |
Compound Name: | 2-[(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)sulfanyl]ethyl hexanoate |
Molecular Weight: | 429.96 |
Molecular Formula: | C23 H24 Cl N O3 S |
Smiles: | CCCCCC(=O)OCCSC1=C(c2ccccc2)c2cc(ccc2NC1=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 5.6526 |
logD: | 5.6518 |
logSw: | -5.7033 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 45.297 |
InChI Key: | XNGVIUQMKUCANY-UHFFFAOYSA-N |