2-(2-chlorophenoxy)-N-[(Z)-(4-pyrrolidin-1-ylphenyl)methylideneamino]acetamide
Formula:C19H20N3O2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-(2-chlorophenoxy)-N-[(Z)-(4-pyrrolidin-1-ylphenyl)methylideneamino]acetamide is a drug-like molecule.
| MolName | 2-(2-chlorophenoxy)-N-[(Z)-(4-pyrrolidin-1-ylphenyl)methylideneamino]acetamide |
| MolecularFormula | C19H20N3O2Cl |
| Smiles | O=C(COc(cccc1)c1Cl)N/N=C\c(cc1)ccc1N1CCCC1 |
| InChI | InChI=1S/C19H20ClN3O2/c20-17-5-1-2-6-18(17)25-14-19(24)22-21-13-15-7-9-16(10-8-15)23-11-3-4-12-23/h1-2,5-10,13H,3-4,11-12,14H2,(H,22,24) |
| InChIK | CWKASOQCXGHDHW-UHFFFAOYSA-N |
| TotalMolweight | 357.84 |
| Molweight | 357.84 |
| MonoisotopicMass | 357.124404 |
| CLogP | 3.8735 |
| CLogS | -4.959 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 278.01 |
| Relative PSA | 0.17827 |
| PolarSurfaceArea | 53.93 |
| Druglikeness | 5.6918 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | low |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.68 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 4 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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