[(Z)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl] N-phenylbenzenecarboximidothioate
Formula:C26H20N2O2S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl] N-phenylbenzenecarboximidothioate is not a drug-like molecule.
| MolName | [(Z)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl] N-phenylbenzenecarboximidothioate |
| MolecularFormula | C26H20N2O2S2 |
| Smiles | O=S(c1ccccc1)(/N=C(/c1ccccc1)\S/C(/c1ccccc1)=N/c1ccccc1)=O |
| InChI | InChI=1S/C26H20N2O2S2/c29-32(30,24-19-11-4-12-20-24)28-26(22-15-7-2-8-16-22)31-25(21-13-5-1-6-14-21)27-23-17-9-3-10-18-23/h1-20H |
| InChIK | MUWHQJCPHSHYNA-UHFFFAOYSA-N |
| TotalMolweight | 456.589 |
| Molweight | 456.589 |
| MonoisotopicMass | 456.096618 |
| CLogP | 5.0191 |
| CLogS | -7.055 |
| H Acceptors | 4 |
| TotalSurfaceArea | 344.55 |
| Relative PSA | 0.20052 |
| PolarSurfaceArea | 92.54 |
| Druglikeness | -4.9375 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.4375 |
| Fragments | 1 |
| Non HAtoms | 32 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 2 |
| Symmetricatoms | 9 |
| StereoCon |
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