4-[(4-chlorophenyl)methoxy]-N-(2-ethylphenyl)-3-methoxybenzamide
Formula:C23H22NO3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
4-[(4-chlorophenyl)methoxy]-N-(2-ethylphenyl)-3-methoxybenzamide is not a drug-like molecule.
| MolName | 4-[(4-chlorophenyl)methoxy]-N-(2-ethylphenyl)-3-methoxybenzamide |
| MolecularFormula | C23H22NO3Cl |
| Smiles | CCc(cccc1)c1NC(c(cc1)cc(OC)c1OCc(cc1)ccc1Cl)=O |
| InChI | InChI=1S/C23H22ClNO3/c1-3-17-6-4-5-7-20(17)25-23(26)18-10-13-21(22(14-18)27-2)28-15-16-8-11-19(24)12-9-16/h4-14H,3,15H2,1-2H3,(H,25,26) |
| InChIK | QPRRHYWYLVOBMJ-UHFFFAOYSA-N |
| TotalMolweight | 395.885 |
| Molweight | 395.885 |
| MonoisotopicMass | 395.128821 |
| CLogP | 5.4507 |
| CLogS | -5.726 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 309.45 |
| Relative PSA | 0.1438 |
| PolarSurfaceArea | 47.56 |
| Druglikeness | 0.40791 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.60714 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 6 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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