5-(2-chlorophenyl)-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide
Formula:C18H11NO3ClF3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
5-(2-chlorophenyl)-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide is not a drug-like molecule.
| MolName | 5-(2-chlorophenyl)-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide |
| MolecularFormula | C18H11NO3ClF3 |
| Smiles | O=C(c1ccc(-c(cccc2)c2Cl)o1)Nc(cc1)ccc1OC(F)(F)F |
| InChI | InChI=1S/C18H11ClF3NO3/c19-14-4-2-1-3-13(14)15-9-10-16(25-15)17(24)23-11-5-7-12(8-6-11)26-18(20,21)22/h1-10H,(H,23,24) |
| InChIK | XPIMQBVVQJZLLB-UHFFFAOYSA-N |
| TotalMolweight | 381.736 |
| Molweight | 381.736 |
| MonoisotopicMass | 381.037955 |
| CLogP | 5.451 |
| CLogS | -6.347 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 266.56 |
| Relative PSA | 0.18236 |
| PolarSurfaceArea | 51.47 |
| Druglikeness | -5.32 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61538 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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