(Z)-1-(2,4-dichlorophenyl)-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methoxy]methanimine
Formula:C16H12NO3Cl2F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-1-(2,4-dichlorophenyl)-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methoxy]methanimine is a drug-like molecule.
| MolName | (Z)-1-(2,4-dichlorophenyl)-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methoxy]methanimine |
| MolecularFormula | C16H12NO3Cl2F |
| Smiles | Fc1cc(CO/N=C\c(ccc(Cl)c2)c2Cl)c2OCOCc2c1 |
| InChI | InChI=1S/C16H12Cl2FNO3/c17-13-2-1-10(15(18)5-13)6-20-23-8-12-4-14(19)3-11-7-21-9-22-16(11)12/h1-6H,7-9H2 |
| InChIK | HNPLKOAVBPXNEL-UHFFFAOYSA-N |
| TotalMolweight | 356.179 |
| Molweight | 356.179 |
| MonoisotopicMass | 355.017826 |
| CLogP | 4.6434 |
| CLogS | -6.133 |
| H Acceptors | 4 |
| TotalSurfaceArea | 252.75 |
| Relative PSA | 0.16423 |
| PolarSurfaceArea | 40.05 |
| Druglikeness | -1.37 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6087 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| StereoCon |
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1 - (Z)-1-(2,4-dichlorophenyl)-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methoxy]methanimine | 2 - (Z)-1-(2,4-dichlorophenyl)-N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methoxy]methanimine
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