| MolName | 4-[5-[(E)-(4-oxo-3-phenyl-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzenesulfonamide |
| MolecularFormula | C26H19N3O4S2 |
| Smiles | NS(c(cc1)ccc1-c1ccc(/C=C(\C(N2c3ccccc3)=O)/S/C2=N\c2ccccc2)o1)(=O)=O |
| InChI | InChI=1S/C26H19N3O4S2/c27-35(31,32)22-14-11-18(12-15-22)23-16-13-21(33-23)17-24-25(30)29(20-9-5-2-6-10-20)26(34-24)28-19-7-3-1-4-8-19/h1-17H,(H2,27,31,32) |
| InChIK | MFSFWAXWUYWIHO-UHFFFAOYSA-N |
| TotalMolweight | 501.586 |
| Molweight | 501.586 |
| MonoisotopicMass | 501.081697 |
| CLogP | 4.3809 |
| CLogS | -7.209 |
| H Acceptors | 7 |
| H Donors | 1 |
| TotalSurfaceArea | 359.05 |
| Relative PSA | 0.2884 |
| PolarSurfaceArea | 139.65 |
| Druglikeness | 6.71 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.51429 |
| Fragments | 1 |
| Non HAtoms | 35 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 5 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Sp3Atoms | 2 |
| Symmetricatoms | 7 |
| Amides | 2 |
| StereoCon |
Click to Load Molecule:
1 - 4-[5-[(E)-(4-oxo-3-phenyl-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzenesulfonamide | 2 - 4-[5-[(E)-(4-oxo-3-phenyl-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzenesulfonamide