3-benzamido-N-[(Z)-furan-2-ylmethylideneamino]benzamide
Formula:C19H15N3O3
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
3-benzamido-N-[(Z)-furan-2-ylmethylideneamino]benzamide is a drug-like molecule.
| MolName | 3-benzamido-N-[(Z)-furan-2-ylmethylideneamino]benzamide |
| MolecularFormula | C19H15N3O3 |
| Smiles | O=C(c1ccccc1)Nc1cccc(C(N/N=C\c2ccco2)=O)c1 |
| InChI | InChI=1S/C19H15N3O3/c23-18(14-6-2-1-3-7-14)21-16-9-4-8-15(12-16)19(24)22-20-13-17-10-5-11-25-17/h1-13H,(H,21,23)(H,22,24) |
| InChIK | GQUVTBRDIIJSQD-UHFFFAOYSA-N |
| TotalMolweight | 333.346 |
| Molweight | 333.346 |
| MonoisotopicMass | 333.111342 |
| CLogP | 3.5378 |
| CLogS | -4.915 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 265.65 |
| Relative PSA | 0.2809 |
| PolarSurfaceArea | 83.7 |
| Druglikeness | 4.6261 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.64 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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