N'-(benzenesulfonyl)-N-benzyl-N-phenylbenzenecarboximidamide
Formula:C26H22N2O2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(benzenesulfonyl)-N-benzyl-N-phenylbenzenecarboximidamide is not a drug-like molecule.
| MolName | N'-(benzenesulfonyl)-N-benzyl-N-phenylbenzenecarboximidamide |
| MolecularFormula | C26H22N2O2S |
| Smiles | O=S(c1ccccc1)(/N=C(/c1ccccc1)\N(Cc1ccccc1)c1ccccc1)=O |
| InChI | InChI=1S/C26H22N2O2S/c29-31(30,25-19-11-4-12-20-25)27-26(23-15-7-2-8-16-23)28(24-17-9-3-10-18-24)21-22-13-5-1-6-14-22/h1-20H,21H2 |
| InChIK | RMPUKRNRVFTEMI-UHFFFAOYSA-N |
| TotalMolweight | 426.539 |
| Molweight | 426.539 |
| MonoisotopicMass | 426.140198 |
| CLogP | 5.6772 |
| CLogS | -5.519 |
| H Acceptors | 4 |
| TotalSurfaceArea | 328.15 |
| Relative PSA | 0.13299 |
| PolarSurfaceArea | 58.12 |
| Druglikeness | -1.8637 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.41935 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 2 |
| Symmetricatoms | 9 |
| BasicNitrogens | 1 |
| StereoCon |
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