N-[(Z)-1-(4-oxo-3,1-benzoxazin-2-yl)-2-phenylethenyl]benzamide
Formula:C23H16N2O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-1-(4-oxo-3,1-benzoxazin-2-yl)-2-phenylethenyl]benzamide is a drug-like molecule.
| MolName | N-[(Z)-1-(4-oxo-3,1-benzoxazin-2-yl)-2-phenylethenyl]benzamide |
| MolecularFormula | C23H16N2O3 |
| Smiles | O=C(c1ccccc1)N/C(/C(O1)=Nc(cccc2)c2C1=O)=C\c1ccccc1 |
| InChI | InChI=1S/C23H16N2O3/c26-21(17-11-5-2-6-12-17)24-20(15-16-9-3-1-4-10-16)22-25-19-14-8-7-13-18(19)23(27)28-22/h1-15H,(H,24,26) |
| InChIK | JIXGQNSCELFPAM-UHFFFAOYSA-N |
| TotalMolweight | 368.391 |
| Molweight | 368.391 |
| MonoisotopicMass | 368.116093 |
| CLogP | 3.993 |
| CLogS | -5.086 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 283.92 |
| Relative PSA | 0.20798 |
| PolarSurfaceArea | 67.76 |
| Druglikeness | 2.0497 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.46429 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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1 - N-[(Z)-1-(4-oxo-3,1-benzoxazin-2-yl)-2-phenylethenyl]benzamide | 2 - N-[(Z)-1-(4-oxo-3,1-benzoxazin-2-yl)-2-phenylethenyl]benzamide
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