2-(4-benzyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
Chemical Structure Depiction of
2-(4-benzyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
2-(4-benzyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
Compound characteristics
Compound ID: | G761-0973 |
Compound Name: | 2-(4-benzyl-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide |
Molecular Weight: | 459.57 |
Molecular Formula: | C26 H25 N3 O3 S |
Smiles: | CSc1ccc(CCNC(CN2C(C(N(Cc3ccccc3)c3ccccc23)=O)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.6697 |
logD: | 3.6697 |
logSw: | -3.8854 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.836 |
InChI Key: | JRXHDZUQAYBQOF-UHFFFAOYSA-N |