N-(3-chlorophenyl)-2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyacetamide
Formula:C23H16NO5Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-(3-chlorophenyl)-2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyacetamide is a drug-like molecule.
| MolName | N-(3-chlorophenyl)-2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyacetamide |
| MolecularFormula | C23H16NO5Cl |
| Smiles | Oc1cc(OCC(Nc2cccc(Cl)c2)=O)cc(OC(c2ccccc2)=C2)c1C2=O |
| InChI | InChI=1S/C23H16ClNO5/c24-15-7-4-8-16(9-15)25-22(28)13-29-17-10-18(26)23-19(27)12-20(30-21(23)11-17)14-5-2-1-3-6-14/h1-12,26H,13H2,(H,25,28) |
| InChIK | ULJBCQKBLSJDAX-UHFFFAOYSA-N |
| TotalMolweight | 421.835 |
| Molweight | 421.835 |
| MonoisotopicMass | 421.071701 |
| CLogP | 4.3555 |
| CLogS | -5.476 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 306.48 |
| Relative PSA | 0.23049 |
| PolarSurfaceArea | 84.86 |
| Druglikeness | 2.2052 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.56667 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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