2-hydroxy-2,2-diphenyl-N-[(Z)-(3-prop-2-ynoxyphenyl)methylideneamino]acetamide
Formula:C24H20N2O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-hydroxy-2,2-diphenyl-N-[(Z)-(3-prop-2-ynoxyphenyl)methylideneamino]acetamide is a drug-like molecule.
| MolName | 2-hydroxy-2,2-diphenyl-N-[(Z)-(3-prop-2-ynoxyphenyl)methylideneamino]acetamide |
| MolecularFormula | C24H20N2O3 |
| Smiles | C#CCOc1cccc(/C=N\NC(C(c2ccccc2)(c2ccccc2)O)=O)c1 |
| InChI | InChI=1S/C24H20N2O3/c1-2-16-29-22-15-9-10-19(17-22)18-25-26-23(27)24(28,20-11-5-3-6-12-20)21-13-7-4-8-14-21/h1,3-15,17-18,28H,16H2,(H,26,27) |
| InChIK | YSVTWIBGZOCADI-UHFFFAOYSA-N |
| TotalMolweight | 384.434 |
| Molweight | 384.434 |
| MonoisotopicMass | 384.147393 |
| CLogP | 3.4391 |
| CLogS | -5.069 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 311.08 |
| Relative PSA | 0.19002 |
| PolarSurfaceArea | 70.92 |
| Druglikeness | 5.1556 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.55172 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 8 |
| StereoCon |
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1 - 2-hydroxy-2,2-diphenyl-N-[(Z)-(3-prop-2-ynoxyphenyl)methylideneamino]acetamide | 2 - 2-hydroxy-2,2-diphenyl-N-[(Z)-(3-prop-2-ynoxyphenyl)methylideneamino]acetamide
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