(E)-N-[(4-chlorophenyl)methyl]-3-(4-phenylmethoxyphenyl)prop-2-enamide
Formula:C23H20NO2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N-[(4-chlorophenyl)methyl]-3-(4-phenylmethoxyphenyl)prop-2-enamide is a drug-like molecule.
| MolName | (E)-N-[(4-chlorophenyl)methyl]-3-(4-phenylmethoxyphenyl)prop-2-enamide |
| MolecularFormula | C23H20NO2Cl |
| Smiles | O=C(/C=C/c(cc1)ccc1OCc1ccccc1)NCc(cc1)ccc1Cl |
| InChI | InChI=1S/C23H20ClNO2/c24-21-11-6-19(7-12-21)16-25-23(26)15-10-18-8-13-22(14-9-18)27-17-20-4-2-1-3-5-20/h1-15H,16-17H2,(H,25,26) |
| InChIK | YULBFGJSMYNBFX-UHFFFAOYSA-N |
| TotalMolweight | 377.87 |
| Molweight | 377.87 |
| MonoisotopicMass | 377.118256 |
| CLogP | 4.7998 |
| CLogS | -5.391 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 301.43 |
| Relative PSA | 0.11445 |
| PolarSurfaceArea | 38.33 |
| Druglikeness | -0.015023 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.74074 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 6 |
| Amides | 1 |
| StereoCon |
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