2-(6-nitro-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-(6-nitro-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
2-(6-nitro-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
Compound ID: | 8017-8256 |
Compound Name: | 2-(6-nitro-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide |
Molecular Weight: | 397.33 |
Molecular Formula: | C16 H10 F3 N3 O4 S |
Smiles: | C(C(Nc1cccc(c1)C(F)(F)F)=O)N1C(c2ccc(cc2S1)[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8574 |
logD: | 3.8572 |
logSw: | -4.1944 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.158 |
InChI Key: | IMXOQYFSWLAYDW-UHFFFAOYSA-N |