2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxy-1-(2,3-dihydroindol-1-yl)ethanone
Formula:C18H16N2O3F2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxy-1-(2,3-dihydroindol-1-yl)ethanone is a drug-like molecule.
| MolName | 2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxy-1-(2,3-dihydroindol-1-yl)ethanone |
| MolecularFormula | C18H16N2O3F2 |
| Smiles | O=C(CO/N=C\c(cc1)ccc1OC(F)F)N(CC1)c2c1cccc2 |
| InChI | InChI=1S/C18H16F2N2O3/c19-18(20)25-15-7-5-13(6-8-15)11-21-24-12-17(23)22-10-9-14-3-1-2-4-16(14)22/h1-8,11,18H,9-10,12H2 |
| InChIK | WWKIBLZAKDSVIX-UHFFFAOYSA-N |
| TotalMolweight | 346.332 |
| Molweight | 346.332 |
| MonoisotopicMass | 346.112899 |
| CLogP | 3.7662 |
| CLogS | -4.54 |
| H Acceptors | 5 |
| TotalSurfaceArea | 258.81 |
| Relative PSA | 0.18585 |
| PolarSurfaceArea | 51.13 |
| Druglikeness | 1.272 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.68 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 3 |
| Amides | 1 |
| StereoCon |
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1 - 2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxy-1-(2,3-dihydroindol-1-yl)ethanone | 2 - 2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxy-1-(2,3-dihydroindol-1-yl)ethanone
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