| MolName | 2-[(2E)-2-(benzenesulfonylimino)-3-cyclohexyl-4-oxo-1,3-thiazolidin-5-yl]-N-(4-chlorophenyl)acetamide |
| MolecularFormula | C23H24N3O4ClS2 |
| Smiles | O=C(CC(C(N1C2CCCCC2)=O)S/C1=N/S(c1ccccc1)(=O)=O)Nc(cc1)ccc1Cl |
| InChI | InChI=1S/C23H24ClN3O4S2/c24-16-11-13-17(14-12-16)25-21(28)15-20-22(29)27(18-7-3-1-4-8-18)23(32-20)26-33(30,31)19-9-5-2-6-10-19/h2,5-6,9-14,18,20H,1,3-4,7-8,15H2,(H,25,28)/t20-/m0/s1 |
| InChIK | OQNYXONWLONXMF-FQEVSTJZSA-N |
| TotalMolweight | 506.046 |
| Molweight | 506.046 |
| MonoisotopicMass | 505.089674 |
| CLogP | 4.5058 |
| CLogS | -5.799 |
| H Acceptors | 7 |
| H Donors | 1 |
| TotalSurfaceArea | 355.3 |
| Relative PSA | 0.27771 |
| PolarSurfaceArea | 129.59 |
| Druglikeness | -5.7177 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.51515 |
| Fragments | 1 |
| Non HAtoms | 33 |
| NonCHAtoms | 10 |
| Electronegative Atoms | 10 |
| StereoCenters | 1 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 10 |
| Symmetricatoms | 7 |
| Amides | 2 |
| StereoCon | racemate |
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1 - 2-[(2E)-2-(benzenesulfonylimino)-3-cyclohexyl-4-oxo-1,3-thiazolidin-5-yl]-N-(4-chlorophenyl)acetamide | 2 - 2-[(2E)-2-(benzenesulfonylimino)-3-cyclohexyl-4-oxo-1,3-thiazolidin-5-yl]-N-(4-chlorophenyl)acetamide