(2E)-2-(benzenesulfonylhydrazinylidene)-N-(3-fluorophenyl)chromene-3-carboxamide
Formula:C22H16N3O4FS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:low
(2E)-2-(benzenesulfonylhydrazinylidene)-N-(3-fluorophenyl)chromene-3-carboxamide is a drug-like molecule.
| MolName | (2E)-2-(benzenesulfonylhydrazinylidene)-N-(3-fluorophenyl)chromene-3-carboxamide |
| MolecularFormula | C22H16N3O4FS |
| Smiles | O=C(C1=Cc(cccc2)c2O/C1=N/NS(c1ccccc1)(=O)=O)Nc1cc(F)ccc1 |
| InChI | InChI=1S/C22H16FN3O4S/c23-16-8-6-9-17(14-16)24-21(27)19-13-15-7-4-5-12-20(15)30-22(19)25-26-31(28,29)18-10-2-1-3-11-18/h1-14,26H,(H,24,27) |
| InChIK | LTAZNQUPQVDQJA-UHFFFAOYSA-N |
| TotalMolweight | 437.45 |
| Molweight | 437.45 |
| MonoisotopicMass | 437.084555 |
| CLogP | 3.1087 |
| CLogS | -3.758 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 312.56 |
| Relative PSA | 0.27531 |
| PolarSurfaceArea | 105.24 |
| Druglikeness | -4.3343 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | twice activated DB |
| Shape Index | 0.48387 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 3 |
| Amides | 1 |
| StereoCon |
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