3-morpholin-4-ylsulfonyl-N-[(E)-(2-oxo-1,2-diphenylethylidene)amino]benzamide
Formula:C25H23N3O5S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
3-morpholin-4-ylsulfonyl-N-[(E)-(2-oxo-1,2-diphenylethylidene)amino]benzamide is a drug-like molecule.
| MolName | 3-morpholin-4-ylsulfonyl-N-[(E)-(2-oxo-1,2-diphenylethylidene)amino]benzamide |
| MolecularFormula | C25H23N3O5S |
| Smiles | O=C(/C(/c1ccccc1)=N/NC(c1cccc(S(N2CCOCC2)(=O)=O)c1)=O)c1ccccc1 |
| InChI | InChI=1S/C25H23N3O5S/c29-24(20-10-5-2-6-11-20)23(19-8-3-1-4-9-19)26-27-25(30)21-12-7-13-22(18-21)34(31,32)28-14-16-33-17-15-28/h1-13,18H,14-17H2,(H,27,30) |
| InChIK | BEHODVCVGNEBSP-UHFFFAOYSA-N |
| TotalMolweight | 477.54 |
| Molweight | 477.54 |
| MonoisotopicMass | 477.135842 |
| CLogP | 2.7359 |
| CLogS | -4.603 |
| H Acceptors | 8 |
| H Donors | 1 |
| TotalSurfaceArea | 353.13 |
| Relative PSA | 0.25821 |
| PolarSurfaceArea | 113.52 |
| Druglikeness | -3.5399 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 34 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 6 |
| Symmetricatoms | 7 |
| Amides | 1 |
| StereoCon |
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1 - 3-morpholin-4-ylsulfonyl-N-[(E)-(2-oxo-1,2-diphenylethylidene)amino]benzamide | 2 - 3-morpholin-4-ylsulfonyl-N-[(E)-(2-oxo-1,2-diphenylethylidene)amino]benzamide
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