N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-2-sulfanylbenzamide
Formula:C14H10N2OCl2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-2-sulfanylbenzamide is a drug-like molecule.
| MolName | N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-2-sulfanylbenzamide |
| MolecularFormula | C14H10N2OCl2S |
| Smiles | O=C(c(cccc1)c1S)N/N=C\c(ccc(Cl)c1)c1Cl |
| InChI | InChI=1S/C14H10Cl2N2OS/c15-10-6-5-9(12(16)7-10)8-17-18-14(19)11-3-1-2-4-13(11)20/h1-8,20H,(H,18,19) |
| InChIK | KLEVFCOAGRHQTN-UHFFFAOYSA-N |
| TotalMolweight | 325.218 |
| Molweight | 325.218 |
| MonoisotopicMass | 323.989087 |
| CLogP | 4.3546 |
| CLogS | -6.299 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 233.69 |
| Relative PSA | 0.25085 |
| PolarSurfaceArea | 80.26 |
| Druglikeness | 2.1414 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| StereoCon |
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1 - N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-2-sulfanylbenzamide | 2 - N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-2-sulfanylbenzamide
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