(NE)-N-[(4-fluorophenyl)-morpholin-4-ylmethylidene]benzenesulfonamide
Formula:C17H17N2O3FS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-[(4-fluorophenyl)-morpholin-4-ylmethylidene]benzenesulfonamide is a drug-like molecule.
| MolName | (NE)-N-[(4-fluorophenyl)-morpholin-4-ylmethylidene]benzenesulfonamide |
| MolecularFormula | C17H17N2O3FS |
| Smiles | O=S(c1ccccc1)(/N=C(\c(cc1)ccc1F)/N1CCOCC1)=O |
| InChI | InChI=1S/C17H17FN2O3S/c18-15-8-6-14(7-9-15)17(20-10-12-23-13-11-20)19-24(21,22)16-4-2-1-3-5-16/h1-9H,10-13H2 |
| InChIK | HNHAIPQQRGXPLX-UHFFFAOYSA-N |
| TotalMolweight | 348.397 |
| Molweight | 348.397 |
| MonoisotopicMass | 348.094391 |
| CLogP | 2.6373 |
| CLogS | -2.732 |
| H Acceptors | 5 |
| TotalSurfaceArea | 252.76 |
| Relative PSA | 0.21222 |
| PolarSurfaceArea | 67.35 |
| Druglikeness | -5.81 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| 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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