2-methoxy-4-(methylsulfanyl)-N-[4-(pyrrolidine-1-sulfonyl)phenyl]benzamide
Chemical Structure Depiction of
2-methoxy-4-(methylsulfanyl)-N-[4-(pyrrolidine-1-sulfonyl)phenyl]benzamide
2-methoxy-4-(methylsulfanyl)-N-[4-(pyrrolidine-1-sulfonyl)phenyl]benzamide
Compound characteristics
Compound ID: | Y030-7123 |
Compound Name: | 2-methoxy-4-(methylsulfanyl)-N-[4-(pyrrolidine-1-sulfonyl)phenyl]benzamide |
Molecular Weight: | 406.52 |
Molecular Formula: | C19 H22 N2 O4 S2 |
Smiles: | COc1cc(ccc1C(Nc1ccc(cc1)S(N1CCCC1)(=O)=O)=O)SC |
Stereo: | ACHIRAL |
logP: | 3.399 |
logD: | 3.1878 |
logSw: | -3.9079 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.037 |
InChI Key: | NCMBSNRYHRFMFK-UHFFFAOYSA-N |