3-chloro-N-[(E)-3-(3-chlorophenyl)iminoprop-1-enyl]aniline
Formula:C15H12N2Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
3-chloro-N-[(E)-3-(3-chlorophenyl)iminoprop-1-enyl]aniline is a drug-like molecule.
| MolName | 3-chloro-N-[(E)-3-(3-chlorophenyl)iminoprop-1-enyl]aniline |
| MolecularFormula | C15H12N2Cl2 |
| Smiles | Clc1cccc(N/C=C/C=N/c2cccc(Cl)c2)c1 |
| InChI | InChI=1S/C15H12Cl2N2/c16-12-4-1-6-14(10-12)18-8-3-9-19-15-7-2-5-13(17)11-15/h1-11,18H |
| InChIK | NWKGXQFLADZTQJ-UHFFFAOYSA-N |
| TotalMolweight | 291.18 |
| Molweight | 291.18 |
| MonoisotopicMass | 290.037752 |
| CLogP | 3.4344 |
| CLogS | -4.868 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 226.58 |
| Relative PSA | 0.10138 |
| PolarSurfaceArea | 24.39 |
| Druglikeness | 0.17099 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.68421 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| StereoCon |
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1 - 3-chloro-N-[(E)-3-(3-chlorophenyl)iminoprop-1-enyl]aniline | 2 - 3-chloro-N-[(E)-3-(3-chlorophenyl)iminoprop-1-enyl]aniline
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