3-nitro-N'-[1,1,1-trifluoro-4-oxo-4-(thiophen-2-yl)butan-2-ylidene]benzohydrazide
Chemical Structure Depiction of
3-nitro-N'-[1,1,1-trifluoro-4-oxo-4-(thiophen-2-yl)butan-2-ylidene]benzohydrazide
3-nitro-N'-[1,1,1-trifluoro-4-oxo-4-(thiophen-2-yl)butan-2-ylidene]benzohydrazide
Compound characteristics
Compound ID: | 8007-7938 |
Compound Name: | 3-nitro-N'-[1,1,1-trifluoro-4-oxo-4-(thiophen-2-yl)butan-2-ylidene]benzohydrazide |
Molecular Weight: | 385.32 |
Molecular Formula: | C15 H10 F3 N3 O4 S |
Smiles: | C(/C(C(F)(F)F)=N/NC(c1cccc(c1)[N+]([O-])=O)=O)C(c1cccs1)=O |
Stereo: | ACHIRAL |
logP: | 3.3056 |
logD: | 3.216 |
logSw: | -3.6932 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.8 |
InChI Key: | NFHCIUSAMJKUAF-UHFFFAOYSA-N |