(NE)-2,4-difluoro-N-[morpholin-4-yl(phenyl)methylidene]benzenesulfonamide
Formula:C17H16N2O3F2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-2,4-difluoro-N-[morpholin-4-yl(phenyl)methylidene]benzenesulfonamide is a drug-like molecule.
| MolName | (NE)-2,4-difluoro-N-[morpholin-4-yl(phenyl)methylidene]benzenesulfonamide |
| MolecularFormula | C17H16N2O3F2S |
| Smiles | O=S(c(ccc(F)c1)c1F)(/N=C(\c1ccccc1)/N1CCOCC1)=O |
| InChI | InChI=1S/C17H16F2N2O3S/c18-14-6-7-16(15(19)12-14)25(22,23)20-17(13-4-2-1-3-5-13)21-8-10-24-11-9-21/h1-7,12H,8-11H2 |
| InChIK | QHJRIJGUOSCQEU-UHFFFAOYSA-N |
| TotalMolweight | 366.387 |
| Molweight | 366.387 |
| MonoisotopicMass | 366.084969 |
| CLogP | 2.7381 |
| CLogS | -3.046 |
| H Acceptors | 5 |
| TotalSurfaceArea | 259.11 |
| Relative PSA | 0.20702 |
| PolarSurfaceArea | 67.35 |
| Druglikeness | 1.0991 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.48 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 5 |
| BasicNitrogens | 1 |
| StereoCon |
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