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 |