N-[(Z)-(3-hydroxyphenyl)methylideneamino]-2-(thiophen-2-ylsulfonylamino)benzamide
Formula:C18H15N3O4S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(3-hydroxyphenyl)methylideneamino]-2-(thiophen-2-ylsulfonylamino)benzamide is a drug-like molecule.
| MolName | N-[(Z)-(3-hydroxyphenyl)methylideneamino]-2-(thiophen-2-ylsulfonylamino)benzamide |
| MolecularFormula | C18H15N3O4S2 |
| Smiles | Oc1cccc(/C=N\NC(c(cccc2)c2NS(c2cccs2)(=O)=O)=O)c1 |
| InChI | InChI=1S/C18H15N3O4S2/c22-14-6-3-5-13(11-14)12-19-20-18(23)15-7-1-2-8-16(15)21-27(24,25)17-9-4-10-26-17/h1-12,21-22H,(H,20,23) |
| InChIK | BTOJQGYNJGWYDG-UHFFFAOYSA-N |
| TotalMolweight | 401.466 |
| Molweight | 401.466 |
| MonoisotopicMass | 401.050397 |
| CLogP | 3.1441 |
| CLogS | -4.675 |
| H Acceptors | 7 |
| H Donors | 3 |
| TotalSurfaceArea | 289.08 |
| Relative PSA | 0.37882 |
| PolarSurfaceArea | 144.48 |
| Druglikeness | 6.2845 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.55556 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 2 |
| Symmetricatoms | 1 |
| Amides | 1 |
| StereoCon |
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