N-[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]-4-(ethylsulfanyl)benzamide
Chemical Structure Depiction of
N-[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]-4-(ethylsulfanyl)benzamide
N-[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]-4-(ethylsulfanyl)benzamide
Compound characteristics
Compound ID: | G841-0092 |
Compound Name: | N-[4-(1,3-benzothiazol-2-yl)-3-hydroxyphenyl]-4-(ethylsulfanyl)benzamide |
Molecular Weight: | 406.52 |
Molecular Formula: | C22 H18 N2 O2 S2 |
Smiles: | CCSc1ccc(cc1)C(Nc1ccc(c(c1)O)c1nc2ccccc2s1)=O |
Stereo: | ACHIRAL |
logP: | 6.1661 |
logD: | 6.1588 |
logSw: | -5.2693 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 49.327 |
InChI Key: | PJIFHKNEPNBUEC-UHFFFAOYSA-N |