2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-[4-(trifluoromethoxy)phenyl]acetamide
Chemical Structure Depiction of
2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-[4-(trifluoromethoxy)phenyl]acetamide
2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-[4-(trifluoromethoxy)phenyl]acetamide
Compound characteristics
Compound ID: | C798-1053 |
Compound Name: | 2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6(5H)-yl)-N-[4-(trifluoromethoxy)phenyl]acetamide |
Molecular Weight: | 445.42 |
Molecular Formula: | C21 H14 F3 N3 O3 S |
Smiles: | C(C(Nc1ccc(cc1)OC(F)(F)F)=O)N1C(c2cccnc2Sc2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 4.8769 |
logD: | 4.8769 |
logSw: | -4.7362 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.539 |
InChI Key: | LACWIAULYSBDEF-UHFFFAOYSA-N |