| MolName | 2-chloro-N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide |
| MolecularFormula | C18H17N2O4Cl |
| Smiles | O=C(/C(/NC(c(cccc1)c1Cl)=O)=C/c1ccco1)N1CCOCC1 |
| InChI | InChI=1S/C18H17ClN2O4/c19-15-6-2-1-5-14(15)17(22)20-16(12-13-4-3-9-25-13)18(23)21-7-10-24-11-8-21/h1-6,9,12H,7-8,10-11H2,(H,20,22) |
| InChIK | PSQLZBVTGCHJQR-UHFFFAOYSA-N |
| TotalMolweight | 360.796 |
| Molweight | 360.796 |
| MonoisotopicMass | 360.087685 |
| CLogP | 2.7453 |
| CLogS | -3.489 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 271.64 |
| Relative PSA | 0.24002 |
| PolarSurfaceArea | 71.78 |
| Druglikeness | 4.6534 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.48 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 5 |
| Symmetricatoms | 2 |
| Amides | 2 |
| StereoCon |
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1 - 2-chloro-N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide | 2 - 2-chloro-N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide