(NE)-N-(3-benzyl-4-oxo-1,3-thiazolidin-2-ylidene)benzenesulfonamide
Formula:C16H14N2O3S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-(3-benzyl-4-oxo-1,3-thiazolidin-2-ylidene)benzenesulfonamide is a drug-like molecule.
| MolName | (NE)-N-(3-benzyl-4-oxo-1,3-thiazolidin-2-ylidene)benzenesulfonamide |
| MolecularFormula | C16H14N2O3S2 |
| Smiles | O=C(CS1)N(Cc2ccccc2)/C1=N\S(c1ccccc1)(=O)=O |
| InChI | InChI=1S/C16H14N2O3S2/c19-15-12-22-16(18(15)11-13-7-3-1-4-8-13)17-23(20,21)14-9-5-2-6-10-14/h1-10H,11-12H2 |
| InChIK | GMAPCKCCWKLAES-UHFFFAOYSA-N |
| TotalMolweight | 346.43 |
| Molweight | 346.43 |
| MonoisotopicMass | 346.044583 |
| CLogP | 2.2496 |
| CLogS | -3.372 |
| H Acceptors | 5 |
| TotalSurfaceArea | 244.13 |
| Relative PSA | 0.30381 |
| PolarSurfaceArea | 100.49 |
| Druglikeness | -2.7367 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.56522 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 4 |
| Symmetricatoms | 5 |
| Amides | 1 |
| StereoCon |
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