N'-(benzenesulfonyl)-N-(4-hydroxyphenyl)benzenecarboximidamide
Formula:C19H16N2O3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(benzenesulfonyl)-N-(4-hydroxyphenyl)benzenecarboximidamide is a drug-like molecule.
| MolName | N'-(benzenesulfonyl)-N-(4-hydroxyphenyl)benzenecarboximidamide |
| MolecularFormula | C19H16N2O3S |
| Smiles | Oc(cc1)ccc1N/C(/c1ccccc1)=N\S(c1ccccc1)(=O)=O |
| InChI | InChI=1S/C19H16N2O3S/c22-17-13-11-16(12-14-17)20-19(15-7-3-1-4-8-15)21-25(23,24)18-9-5-2-6-10-18/h1-14,22H,(H,20,21) |
| InChIK | VDONTALRFFJUOH-UHFFFAOYSA-N |
| TotalMolweight | 352.413 |
| Molweight | 352.413 |
| MonoisotopicMass | 352.088163 |
| CLogP | 3.664 |
| CLogS | -3.924 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 262.14 |
| Relative PSA | 0.24662 |
| PolarSurfaceArea | 87.14 |
| Druglikeness | -5.4252 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 7 |
| BasicNitrogens | 1 |
| StereoCon |
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