N-[(Z)-(4-bromophenyl)methylideneamino]-3-[(2-chlorophenyl)sulfamoyl]benzamide
Formula:C20H15N3O3BrClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(4-bromophenyl)methylideneamino]-3-[(2-chlorophenyl)sulfamoyl]benzamide is a drug-like molecule.
| MolName | N-[(Z)-(4-bromophenyl)methylideneamino]-3-[(2-chlorophenyl)sulfamoyl]benzamide |
| MolecularFormula | C20H15N3O3BrClS |
| Smiles | O=C(c1cc(S(Nc(cccc2)c2Cl)(=O)=O)ccc1)N/N=C\c(cc1)ccc1Br |
| InChI | InChI=1S/C20H15BrClN3O3S/c21-16-10-8-14(9-11-16)13-23-24-20(26)15-4-3-5-17(12-15)29(27,28)25-19-7-2-1-6-18(19)22/h1-13,25H,(H,24,26) |
| InChIK | OVMHMNZVFWGMAB-UHFFFAOYSA-N |
| TotalMolweight | 492.78 |
| Molweight | 492.78 |
| MonoisotopicMass | 490.9706 |
| CLogP | 4.8319 |
| CLogS | -6.624 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 320.84 |
| Relative PSA | 0.23703 |
| PolarSurfaceArea | 96.01 |
| Druglikeness | -0.82723 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.62069 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 3 |
| Amides | 1 |
| StereoCon |
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