(NZ)-N-[(4-nitrophenyl)methylidene]benzenesulfonamide
Formula:C13H10N2O4S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(4-nitrophenyl)methylidene]benzenesulfonamide is a drug-like molecule.
| MolName | (NZ)-N-[(4-nitrophenyl)methylidene]benzenesulfonamide |
| MolecularFormula | C13H10N2O4S |
| Smiles | [O-][N+](c1ccc(/C=N\S(c2ccccc2)(=O)=O)cc1)=O |
| InChI | InChI=1S/C13H10N2O4S/c16-15(17)12-8-6-11(7-9-12)10-14-20(18,19)13-4-2-1-3-5-13/h1-10H |
| InChIK | UTEMAUWNVOCGDI-UHFFFAOYSA-N |
| TotalMolweight | 290.298 |
| Molweight | 290.298 |
| MonoisotopicMass | 290.036128 |
| CLogP | 1.5758 |
| CLogS | -3.492 |
| H Acceptors | 6 |
| TotalSurfaceArea | 210.03 |
| Relative PSA | 0.33571 |
| PolarSurfaceArea | 100.7 |
| Druglikeness | -17.023 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | aromatic nitro |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 5 |
| BasicNitrogens | 1 |
| AcidicOxygens | 1 |
| StereoCon |
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