| MolName | N-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]phenyl]furan-2-carboxamide |
| MolecularFormula | C20H13NO3Cl2 |
| Smiles | O=C(/C=C/c(ccc(Cl)c1)c1Cl)c(cc1)ccc1NC(c1ccco1)=O |
| InChI | InChI=1S/C20H13Cl2NO3/c21-15-7-3-13(17(22)12-15)6-10-18(24)14-4-8-16(9-5-14)23-20(25)19-2-1-11-26-19/h1-12H,(H,23,25) |
| InChIK | RPSAMOPNICWICB-UHFFFAOYSA-N |
| TotalMolweight | 386.233 |
| Molweight | 386.233 |
| MonoisotopicMass | 385.027248 |
| CLogP | 4.852 |
| CLogS | -6.506 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 286.77 |
| Relative PSA | 0.18011 |
| PolarSurfaceArea | 59.31 |
| Druglikeness | 2.414 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65385 |
| 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 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - N-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]phenyl]furan-2-carboxamide | 2 - N-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]phenyl]furan-2-carboxamide