N'-(benzenesulfonyl)-N-[4-(difluoromethylsulfanyl)phenyl]benzenecarboximidamide
Formula:C20H16N2O2F2S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(benzenesulfonyl)-N-[4-(difluoromethylsulfanyl)phenyl]benzenecarboximidamide is not a drug-like molecule.
| MolName | N'-(benzenesulfonyl)-N-[4-(difluoromethylsulfanyl)phenyl]benzenecarboximidamide |
| MolecularFormula | C20H16N2O2F2S2 |
| Smiles | O=S(c1ccccc1)(/N=C(\c1ccccc1)/Nc(cc1)ccc1SC(F)F)=O |
| InChI | InChI=1S/C20H16F2N2O2S2/c21-20(22)27-17-13-11-16(12-14-17)23-19(15-7-3-1-4-8-15)24-28(25,26)18-9-5-2-6-10-18/h1-14,20H,(H,23,24) |
| InChIK | IRRKQOUZNGACNZ-UHFFFAOYSA-N |
| TotalMolweight | 418.487 |
| Molweight | 418.487 |
| MonoisotopicMass | 418.062124 |
| CLogP | 5.9046 |
| CLogS | -5.689 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 298.48 |
| Relative PSA | 0.23131 |
| PolarSurfaceArea | 92.21 |
| Druglikeness | -8.2214 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.53571 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 8 |
| BasicNitrogens | 1 |
| StereoCon |
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