N-[(Z)-(2-bromophenyl)methylideneamino]-4-chlorobenzenesulfonamide
Formula:C13H10N2O2BrClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(2-bromophenyl)methylideneamino]-4-chlorobenzenesulfonamide is a drug-like molecule.
| MolName | N-[(Z)-(2-bromophenyl)methylideneamino]-4-chlorobenzenesulfonamide |
| MolecularFormula | C13H10N2O2BrClS |
| Smiles | O=S(c(cc1)ccc1Cl)(N/N=C\c(cccc1)c1Br)=O |
| InChI | InChI=1S/C13H10BrClN2O2S/c14-13-4-2-1-3-10(13)9-16-17-20(18,19)12-7-5-11(15)6-8-12/h1-9,17H |
| InChIK | MJGNWDGZIVLVIZ-UHFFFAOYSA-N |
| TotalMolweight | 373.657 |
| Molweight | 373.657 |
| MonoisotopicMass | 371.933486 |
| CLogP | 3.6083 |
| CLogS | -3.486 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 231.87 |
| Relative PSA | 0.22232 |
| PolarSurfaceArea | 66.91 |
| Druglikeness | -0.25247 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 3 |
| StereoCon |
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1 - N-[(Z)-(2-bromophenyl)methylideneamino]-4-chlorobenzenesulfonamide | 2 - N-[(Z)-(2-bromophenyl)methylideneamino]-4-chlorobenzenesulfonamide
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