[4-[(Z)-(naphthalen-2-ylsulfonylhydrazinylidene)methyl]phenyl] 3-chlorobenzoate
Formula:C24H17N2O4ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[4-[(Z)-(naphthalen-2-ylsulfonylhydrazinylidene)methyl]phenyl] 3-chlorobenzoate is not a drug-like molecule.
| MolName | [4-[(Z)-(naphthalen-2-ylsulfonylhydrazinylidene)methyl]phenyl] 3-chlorobenzoate |
| MolecularFormula | C24H17N2O4ClS |
| Smiles | O=C(c1cccc(Cl)c1)Oc1ccc(/C=N\NS(c2cc3ccccc3cc2)(=O)=O)cc1 |
| InChI | InChI=1S/C24H17ClN2O4S/c25-21-7-3-6-20(14-21)24(28)31-22-11-8-17(9-12-22)16-26-27-32(29,30)23-13-10-18-4-1-2-5-19(18)15-23/h1-16,27H |
| InChIK | BZKWWSNOIMDJAG-UHFFFAOYSA-N |
| TotalMolweight | 464.928 |
| Molweight | 464.928 |
| MonoisotopicMass | 464.059755 |
| CLogP | 5.508 |
| CLogS | -5.728 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 335.35 |
| Relative PSA | 0.22242 |
| PolarSurfaceArea | 93.21 |
| Druglikeness | 0.12545 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.625 |
| Fragments | 1 |
| Non HAtoms | 32 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 2 |
| Symmetricatoms | 3 |
| StereoCon |
Click to Load Molecule:
1 - [4-[(Z)-(naphthalen-2-ylsulfonylhydrazinylidene)methyl]phenyl] 3-chlorobenzoate | 2 - [4-[(Z)-(naphthalen-2-ylsulfonylhydrazinylidene)methyl]phenyl] 3-chlorobenzoate
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