N'-(benzenesulfonyl)-4-chloro-N-(2-iodophenyl)benzenecarboximidamide
Formula:C19H14N2O2ClIS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(benzenesulfonyl)-4-chloro-N-(2-iodophenyl)benzenecarboximidamide is not a drug-like molecule.
| MolName | N'-(benzenesulfonyl)-4-chloro-N-(2-iodophenyl)benzenecarboximidamide |
| MolecularFormula | C19H14N2O2ClIS |
| Smiles | O=S(c1ccccc1)(/N=C(/c(cc1)ccc1Cl)\Nc(cccc1)c1I)=O |
| InChI | InChI=1S/C19H14ClIN2O2S/c20-15-12-10-14(11-13-15)19(22-18-9-5-4-8-17(18)21)23-26(24,25)16-6-2-1-3-7-16/h1-13H,(H,22,23) |
| InChIK | NPDLYMPTGLEQQV-UHFFFAOYSA-N |
| TotalMolweight | 496.751 |
| Molweight | 496.751 |
| MonoisotopicMass | 495.950923 |
| CLogP | 5.0528 |
| CLogS | -5.972 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 297.49 |
| Relative PSA | 0.17328 |
| PolarSurfaceArea | 66.91 |
| Druglikeness | -4.2548 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.46154 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 5 |
| BasicNitrogens | 1 |
| StereoCon |
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