(E)-3-(4-chlorophenyl)-N-[4-(2-phenylethylsulfamoyl)phenyl]prop-2-enamide
Formula:C23H21N2O3ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-3-(4-chlorophenyl)-N-[4-(2-phenylethylsulfamoyl)phenyl]prop-2-enamide is a drug-like molecule.
| MolName | (E)-3-(4-chlorophenyl)-N-[4-(2-phenylethylsulfamoyl)phenyl]prop-2-enamide |
| MolecularFormula | C23H21N2O3ClS |
| Smiles | O=C(/C=C/c(cc1)ccc1Cl)Nc(cc1)ccc1S(NCCc1ccccc1)(=O)=O |
| InChI | InChI=1S/C23H21ClN2O3S/c24-20-9-6-19(7-10-20)8-15-23(27)26-21-11-13-22(14-12-21)30(28,29)25-17-16-18-4-2-1-3-5-18/h1-15,25H,16-17H2,(H,26,27) |
| InChIK | QWDPNRJQWYECKY-UHFFFAOYSA-N |
| TotalMolweight | 440.95 |
| Molweight | 440.95 |
| MonoisotopicMass | 440.09614 |
| CLogP | 4.7159 |
| CLogS | -5.222 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 331.47 |
| Relative PSA | 0.19471 |
| PolarSurfaceArea | 83.65 |
| Druglikeness | 4.6788 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 7 |
| Amides | 2 |
| StereoCon |
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