(E)-N-[3,5-bis(trifluoromethyl)phenyl]-3-thiophen-3-ylprop-2-enamide
Formula:C15H9NOF6S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N-[3,5-bis(trifluoromethyl)phenyl]-3-thiophen-3-ylprop-2-enamide is a drug-like molecule.
| MolName | (E)-N-[3,5-bis(trifluoromethyl)phenyl]-3-thiophen-3-ylprop-2-enamide |
| MolecularFormula | C15H9NOF6S |
| Smiles | O=C(/C=C/c1cscc1)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 |
| InChI | InChI=1S/C15H9F6NOS/c16-14(17,18)10-5-11(15(19,20)21)7-12(6-10)22-13(23)2-1-9-3-4-24-8-9/h1-8H,(H,22,23) |
| InChIK | MFGQXOZGVVVYAV-UHFFFAOYSA-N |
| TotalMolweight | 365.296 |
| Molweight | 365.296 |
| MonoisotopicMass | 365.030902 |
| CLogP | 4.6173 |
| CLogS | -4.954 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 243.59 |
| Relative PSA | 0.18416 |
| PolarSurfaceArea | 57.34 |
| Druglikeness | -6.8688 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 2 |
| Symmetricatoms | 8 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - (E)-N-[3,5-bis(trifluoromethyl)phenyl]-3-thiophen-3-ylprop-2-enamide | 2 - (E)-N-[3,5-bis(trifluoromethyl)phenyl]-3-thiophen-3-ylprop-2-enamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off