N-[(2,4-dichlorophenyl)methyl]-2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide
Formula:C17H14N2O3Cl2F2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(2,4-dichlorophenyl)methyl]-2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide is a drug-like molecule.
| MolName | N-[(2,4-dichlorophenyl)methyl]-2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide |
| MolecularFormula | C17H14N2O3Cl2F2 |
| Smiles | O=C(CO/N=C\c(cc1)ccc1OC(F)F)NCc(ccc(Cl)c1)c1Cl |
| InChI | InChI=1S/C17H14Cl2F2N2O3/c18-13-4-3-12(15(19)7-13)9-22-16(24)10-25-23-8-11-1-5-14(6-2-11)26-17(20)21/h1-8,17H,9-10H2,(H,22,24) |
| InChIK | GQCZUISMPLPFEM-UHFFFAOYSA-N |
| TotalMolweight | 403.211 |
| Molweight | 403.211 |
| MonoisotopicMass | 402.034953 |
| CLogP | 4.3008 |
| CLogS | -5.503 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 290.55 |
| Relative PSA | 0.19277 |
| PolarSurfaceArea | 59.92 |
| Druglikeness | -0.12941 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.73077 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 8 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Symmetricatoms | 3 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - N-[(2,4-dichlorophenyl)methyl]-2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide | 2 - N-[(2,4-dichlorophenyl)methyl]-2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off