| MolName | (Z)-1-(2,4-dichlorophenyl)-N-[(2,5-dichlorothiophen-3-yl)methoxy]methanimine |
| MolecularFormula | C12H7NOCl4S |
| Smiles | Clc(s1)cc(CO/N=C\c(ccc(Cl)c2)c2Cl)c1Cl |
| InChI | InChI=1S/C12H7Cl4NOS/c13-9-2-1-7(10(14)4-9)5-17-18-6-8-3-11(15)19-12(8)16/h1-5H,6H2 |
| InChIK | LTRWZBIQBIBYQH-UHFFFAOYSA-N |
| TotalMolweight | 355.072 |
| Molweight | 355.072 |
| MonoisotopicMass | 352.900242 |
| CLogP | 6.4535 |
| CLogS | -6.52 |
| H Acceptors | 2 |
| TotalSurfaceArea | 239.16 |
| Relative PSA | 0.17507 |
| PolarSurfaceArea | 49.83 |
| Druglikeness | 1.1946 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.68421 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 2 |
| StereoCon |
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1 - (Z)-1-(2,4-dichlorophenyl)-N-[(2,5-dichlorothiophen-3-yl)methoxy]methanimine | 2 - (Z)-1-(2,4-dichlorophenyl)-N-[(2,5-dichlorothiophen-3-yl)methoxy]methanimine