| MolName | N-(2-chlorophenyl)-3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzamide |
| MolecularFormula | C20H15N2O3Cl |
| Smiles | O=C(/C=C/c1ccco1)Nc1cccc(C(Nc(cccc2)c2Cl)=O)c1 |
| InChI | InChI=1S/C20H15ClN2O3/c21-17-8-1-2-9-18(17)23-20(25)14-5-3-6-15(13-14)22-19(24)11-10-16-7-4-12-26-16/h1-13H,(H,22,24)(H,23,25) |
| InChIK | KFYVCKKSCMJRJR-UHFFFAOYSA-N |
| TotalMolweight | 366.803 |
| Molweight | 366.803 |
| MonoisotopicMass | 366.07712 |
| CLogP | 4.0785 |
| CLogS | -5.428 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 282.81 |
| Relative PSA | 0.22315 |
| PolarSurfaceArea | 71.34 |
| Druglikeness | -0.18485 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | low |
| Nasty Functions | |
| Shape Index | 0.61538 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Amides | 2 |
| StereoCon |
Click to Load Molecule:
1 - N-(2-chlorophenyl)-3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzamide | 2 - N-(2-chlorophenyl)-3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzamide