| MolName | N'-(benzenesulfonyl)-2,2,2-trichloro-N-phenylethanimidamide |
| MolecularFormula | C14H11N2O2Cl3S |
| Smiles | O=S(c1ccccc1)(/N=C(/C(Cl)(Cl)Cl)\Nc1ccccc1)=O |
| InChI | InChI=1S/C14H11Cl3N2O2S/c15-14(16,17)13(18-11-7-3-1-4-8-11)19-22(20,21)12-9-5-2-6-10-12/h1-10H,(H,18,19) |
| InChIK | IKNGBFBUGGMHTC-UHFFFAOYSA-N |
| TotalMolweight | 377.678 |
| Molweight | 377.678 |
| MonoisotopicMass | 375.960679 |
| CLogP | 4.0104 |
| CLogS | -4.251 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 252.7 |
| Relative PSA | 0.204 |
| PolarSurfaceArea | 66.91 |
| Druglikeness | -7.7422 |
| Mutagenic | high |
| Tumorigenic | low |
| Reproductive Effective | high |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.54545 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 7 |
| BasicNitrogens | 1 |
| StereoCon |
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