(E)-N-[4-[(2,4-dichlorophenyl)sulfamoyl]phenyl]-3-phenylprop-2-enamide
Formula:C21H16N2O3Cl2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N-[4-[(2,4-dichlorophenyl)sulfamoyl]phenyl]-3-phenylprop-2-enamide is a drug-like molecule.
| MolName | (E)-N-[4-[(2,4-dichlorophenyl)sulfamoyl]phenyl]-3-phenylprop-2-enamide |
| MolecularFormula | C21H16N2O3Cl2S |
| Smiles | O=C(/C=C/c1ccccc1)Nc(cc1)ccc1S(Nc(ccc(Cl)c1)c1Cl)(=O)=O |
| InChI | InChI=1S/C21H16Cl2N2O3S/c22-16-7-12-20(19(23)14-16)25-29(27,28)18-10-8-17(9-11-18)24-21(26)13-6-15-4-2-1-3-5-15/h1-14,25H,(H,24,26) |
| InChIK | BUVIKYZZODHKDF-UHFFFAOYSA-N |
| TotalMolweight | 447.341 |
| Molweight | 447.341 |
| MonoisotopicMass | 446.025867 |
| CLogP | 4.6474 |
| CLogS | -6.303 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 319.37 |
| Relative PSA | 0.20209 |
| PolarSurfaceArea | 83.65 |
| Druglikeness | 2.7826 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65517 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 5 |
| Amides | 2 |
| StereoCon |
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1 - (E)-N-[4-[(2,4-dichlorophenyl)sulfamoyl]phenyl]-3-phenylprop-2-enamide | 2 - (E)-N-[4-[(2,4-dichlorophenyl)sulfamoyl]phenyl]-3-phenylprop-2-enamide
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