(E)-N-[4-(cyclohexylsulfamoyl)phenyl]-3-thiophen-2-ylprop-2-enamide
Formula:C19H22N2O3S2
Mutagenic:none
Tumorigenic:low
Reproductive Effective:high
(E)-N-[4-(cyclohexylsulfamoyl)phenyl]-3-thiophen-2-ylprop-2-enamide is a drug-like molecule.
| MolName | (E)-N-[4-(cyclohexylsulfamoyl)phenyl]-3-thiophen-2-ylprop-2-enamide |
| MolecularFormula | C19H22N2O3S2 |
| Smiles | O=C(/C=C/c1cccs1)Nc(cc1)ccc1S(NC1CCCCC1)(=O)=O |
| InChI | InChI=1S/C19H22N2O3S2/c22-19(13-10-17-7-4-14-25-17)20-15-8-11-18(12-9-15)26(23,24)21-16-5-2-1-3-6-16/h4,7-14,16,21H,1-3,5-6H2,(H,20,22) |
| InChIK | LWFDOYKSSUDCOA-UHFFFAOYSA-N |
| TotalMolweight | 390.527 |
| Molweight | 390.527 |
| MonoisotopicMass | 390.107183 |
| CLogP | 3.684 |
| CLogS | -4.635 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 292.51 |
| Relative PSA | 0.29025 |
| PolarSurfaceArea | 111.89 |
| Druglikeness | -0.22166 |
| Mutagenic | none |
| Tumorigenic | low |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65385 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 7 |
| Symmetricatoms | 5 |
| Amides | 2 |
| StereoCon |
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1 - (E)-N-[4-(cyclohexylsulfamoyl)phenyl]-3-thiophen-2-ylprop-2-enamide | 2 - (E)-N-[4-(cyclohexylsulfamoyl)phenyl]-3-thiophen-2-ylprop-2-enamide
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