phenyl (Z)-N-(benzenesulfonyl)benzenecarboximidothioate
Formula:C19H15NO2S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
phenyl (Z)-N-(benzenesulfonyl)benzenecarboximidothioate is a drug-like molecule.
| MolName | phenyl (Z)-N-(benzenesulfonyl)benzenecarboximidothioate |
| MolecularFormula | C19H15NO2S2 |
| Smiles | O=S(c1ccccc1)(/N=C(/c1ccccc1)\Sc1ccccc1)=O |
| InChI | InChI=1S/C19H15NO2S2/c21-24(22,18-14-8-3-9-15-18)20-19(16-10-4-1-5-11-16)23-17-12-6-2-7-13-17/h1-15H |
| InChIK | IDXQKDHOBOVGDE-UHFFFAOYSA-N |
| TotalMolweight | 353.465 |
| Molweight | 353.465 |
| MonoisotopicMass | 353.054419 |
| CLogP | 4.2127 |
| CLogS | -5.365 |
| H Acceptors | 3 |
| TotalSurfaceArea | 261.82 |
| Relative PSA | 0.21992 |
| PolarSurfaceArea | 80.18 |
| Druglikeness | -6.0145 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 7 |
| StereoCon |
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