2-[(4-chlorophenyl)methylsulfanyl]-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]acetamide
Formula:C23H21N2O2ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(4-chlorophenyl)methylsulfanyl]-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]acetamide is not a drug-like molecule.
| MolName | 2-[(4-chlorophenyl)methylsulfanyl]-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]acetamide |
| MolecularFormula | C23H21N2O2ClS |
| Smiles | O=C(CSCc(cc1)ccc1Cl)N/N=C\c(cccc1)c1OCc1ccccc1 |
| InChI | InChI=1S/C23H21ClN2O2S/c24-21-12-10-19(11-13-21)16-29-17-23(27)26-25-14-20-8-4-5-9-22(20)28-15-18-6-2-1-3-7-18/h1-14H,15-17H2,(H,26,27) |
| InChIK | SUFONNJNIGPUHF-UHFFFAOYSA-N |
| TotalMolweight | 424.951 |
| Molweight | 424.951 |
| MonoisotopicMass | 424.101225 |
| CLogP | 5.3453 |
| CLogS | -6.584 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 330.94 |
| Relative PSA | 0.19188 |
| PolarSurfaceArea | 75.99 |
| Druglikeness | 4.3932 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.68966 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 9 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 5 |
| Symmetricatoms | 4 |
| StereoCon |
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