3-[(3-chlorophenyl)sulfamoyl]-N-[(Z)-furan-2-ylmethylideneamino]benzamide
Formula:C18H14N3O4ClS
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
3-[(3-chlorophenyl)sulfamoyl]-N-[(Z)-furan-2-ylmethylideneamino]benzamide is a drug-like molecule.
| MolName | 3-[(3-chlorophenyl)sulfamoyl]-N-[(Z)-furan-2-ylmethylideneamino]benzamide |
| MolecularFormula | C18H14N3O4ClS |
| Smiles | O=C(c1cccc(S(Nc2cccc(Cl)c2)(=O)=O)c1)N/N=C\c1ccco1 |
| InChI | InChI=1S/C18H14ClN3O4S/c19-14-5-2-6-15(11-14)22-27(24,25)17-8-1-4-13(10-17)18(23)21-20-12-16-7-3-9-26-16/h1-12,22H,(H,21,23) |
| InChIK | BEHGEYOLOZRWCU-UHFFFAOYSA-N |
| TotalMolweight | 403.845 |
| Molweight | 403.845 |
| MonoisotopicMass | 403.039354 |
| CLogP | 3.2954 |
| CLogS | -5.472 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 291.9 |
| Relative PSA | 0.30887 |
| PolarSurfaceArea | 109.15 |
| Druglikeness | 0.84603 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.59259 |
| 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 | 1 |
| Symmetricatoms | 1 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - 3-[(3-chlorophenyl)sulfamoyl]-N-[(Z)-furan-2-ylmethylideneamino]benzamide | 2 - 3-[(3-chlorophenyl)sulfamoyl]-N-[(Z)-furan-2-ylmethylideneamino]benzamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off