4-chloro-N-[(Z)-[(4-chlorophenyl)methoxyamino]methylideneamino]benzamide
Formula:C15H13N3O2Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-chloro-N-[(Z)-[(4-chlorophenyl)methoxyamino]methylideneamino]benzamide is a drug-like molecule.
| MolName | 4-chloro-N-[(Z)-[(4-chlorophenyl)methoxyamino]methylideneamino]benzamide |
| MolecularFormula | C15H13N3O2Cl2 |
| Smiles | O=C(c(cc1)ccc1Cl)N/N=C\NOCc(cc1)ccc1Cl |
| InChI | InChI=1S/C15H13Cl2N3O2/c16-13-5-1-11(2-6-13)9-22-19-10-18-20-15(21)12-3-7-14(17)8-4-12/h1-8,10H,9H2,(H,18,19)(H,20,21) |
| InChIK | KZNLOBXHXDLNHG-UHFFFAOYSA-N |
| TotalMolweight | 338.193 |
| Molweight | 338.193 |
| MonoisotopicMass | 337.038481 |
| CLogP | 3.2578 |
| CLogS | -5.483 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 253.05 |
| Relative PSA | 0.22711 |
| PolarSurfaceArea | 62.72 |
| Druglikeness | 3.407 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.77273 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| StereoCon |
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