N-[(E)-[phenyl(pyridin-4-yl)methylidene]amino]benzenesulfonamide
Formula:C18H15N3O2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(E)-[phenyl(pyridin-4-yl)methylidene]amino]benzenesulfonamide is a drug-like molecule.
| MolName | N-[(E)-[phenyl(pyridin-4-yl)methylidene]amino]benzenesulfonamide |
| MolecularFormula | C18H15N3O2S |
| Smiles | O=S(c1ccccc1)(N/N=C(\c1ccccc1)/c1ccncc1)=O |
| InChI | InChI=1S/C18H15N3O2S/c22-24(23,17-9-5-2-6-10-17)21-20-18(15-7-3-1-4-8-15)16-11-13-19-14-12-16/h1-14,21H |
| InChIK | YODPGYYIKDAKTI-UHFFFAOYSA-N |
| TotalMolweight | 337.402 |
| Molweight | 337.402 |
| MonoisotopicMass | 337.088497 |
| CLogP | 2.4729 |
| CLogS | -2.897 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 254.55 |
| Relative PSA | 0.24561 |
| PolarSurfaceArea | 79.8 |
| Druglikeness | -5.4391 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 7 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - N-[(E)-[phenyl(pyridin-4-yl)methylidene]amino]benzenesulfonamide | 2 - N-[(E)-[phenyl(pyridin-4-yl)methylidene]amino]benzenesulfonamide
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