(E)-3-(3-fluorophenyl)-N-(3-sulfamoylphenyl)prop-2-enamide
Formula:C15H13N2O3FS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-3-(3-fluorophenyl)-N-(3-sulfamoylphenyl)prop-2-enamide is a drug-like molecule.
| MolName | (E)-3-(3-fluorophenyl)-N-(3-sulfamoylphenyl)prop-2-enamide |
| MolecularFormula | C15H13N2O3FS |
| Smiles | NS(c1cc(NC(/C=C/c2cc(F)ccc2)=O)ccc1)(=O)=O |
| InChI | InChI=1S/C15H13FN2O3S/c16-12-4-1-3-11(9-12)7-8-15(19)18-13-5-2-6-14(10-13)22(17,20)21/h1-10H,(H,18,19)(H2,17,20,21) |
| InChIK | WIYGPWPMFWVDFT-UHFFFAOYSA-N |
| TotalMolweight | 320.343 |
| Molweight | 320.343 |
| MonoisotopicMass | 320.063091 |
| CLogP | 2.0011 |
| CLogS | -3.711 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 232.18 |
| Relative PSA | 0.29438 |
| PolarSurfaceArea | 97.64 |
| Druglikeness | -6.6572 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.59091 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 1 |
| Amides | 2 |
| StereoCon |
Click to Load Molecule:
1 - (E)-3-(3-fluorophenyl)-N-(3-sulfamoylphenyl)prop-2-enamide | 2 - (E)-3-(3-fluorophenyl)-N-(3-sulfamoylphenyl)prop-2-enamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off