(E)-N-(5-chloro-2-morpholin-4-ylphenyl)-3-(4-chlorophenyl)prop-2-enamide
Formula:C19H18N2O2Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N-(5-chloro-2-morpholin-4-ylphenyl)-3-(4-chlorophenyl)prop-2-enamide is a drug-like molecule.
| MolName | (E)-N-(5-chloro-2-morpholin-4-ylphenyl)-3-(4-chlorophenyl)prop-2-enamide |
| MolecularFormula | C19H18N2O2Cl2 |
| Smiles | O=C(/C=C/c(cc1)ccc1Cl)Nc(cc(cc1)Cl)c1N1CCOCC1 |
| InChI | InChI=1S/C19H18Cl2N2O2/c20-15-4-1-14(2-5-15)3-8-19(24)22-17-13-16(21)6-7-18(17)23-9-11-25-12-10-23/h1-8,13H,9-12H2,(H,22,24) |
| InChIK | LPOVXXVVLIPQEO-UHFFFAOYSA-N |
| TotalMolweight | 377.27 |
| Molweight | 377.27 |
| MonoisotopicMass | 376.074532 |
| CLogP | 4.0173 |
| CLogS | -5.073 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 281.41 |
| Relative PSA | 0.13521 |
| PolarSurfaceArea | 41.57 |
| Druglikeness | 1.0429 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 4 |
| Amides | 1 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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