5,7-dichloroquinolin-8-yl 2,4-dimethoxybenzene-1-sulfonate
Chemical Structure Depiction of
5,7-dichloroquinolin-8-yl 2,4-dimethoxybenzene-1-sulfonate
5,7-dichloroquinolin-8-yl 2,4-dimethoxybenzene-1-sulfonate
Compound characteristics
Compound ID: | 8012-2147 |
Compound Name: | 5,7-dichloroquinolin-8-yl 2,4-dimethoxybenzene-1-sulfonate |
Molecular Weight: | 414.26 |
Molecular Formula: | C17 H13 Cl2 N O5 S |
Smiles: | COc1ccc(c(c1)OC)S(=O)(=O)Oc1c(cc(c2cccnc12)[Cl])[Cl] |
Stereo: | ACHIRAL |
logP: | 4.2288 |
logD: | 4.2134 |
logSw: | -4.7373 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 60.881 |
InChI Key: | NDYBZMJNBATMPS-UHFFFAOYSA-N |