(NE)-N-[phenyl(piperidin-1-yl)methylidene]benzenesulfonamide
Formula:C18H20N2O2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-[phenyl(piperidin-1-yl)methylidene]benzenesulfonamide is a drug-like molecule.
| MolName | (NE)-N-[phenyl(piperidin-1-yl)methylidene]benzenesulfonamide |
| MolecularFormula | C18H20N2O2S |
| Smiles | O=S(c1ccccc1)(/N=C(\c1ccccc1)/N1CCCCC1)=O |
| InChI | InChI=1S/C18H20N2O2S/c21-23(22,17-12-6-2-7-13-17)19-18(16-10-4-1-5-11-16)20-14-8-3-9-15-20/h1-2,4-7,10-13H,3,8-9,14-15H2 |
| InChIK | ZLBSWMRNLORGOF-UHFFFAOYSA-N |
| TotalMolweight | 328.435 |
| Molweight | 328.435 |
| MonoisotopicMass | 328.124548 |
| CLogP | 3.7005 |
| CLogS | -3.307 |
| H Acceptors | 4 |
| TotalSurfaceArea | 250.17 |
| Relative PSA | 0.17444 |
| PolarSurfaceArea | 58.12 |
| Druglikeness | -5.429 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.47826 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 7 |
| BasicNitrogens | 1 |
| StereoCon |
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