N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-naphthalen-1-ylsulfanylacetamide
Formula:C26H21N2O2ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-naphthalen-1-ylsulfanylacetamide is not a drug-like molecule.
| MolName | N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-naphthalen-1-ylsulfanylacetamide |
| MolecularFormula | C26H21N2O2ClS |
| Smiles | O=C(CSc1cccc2ccccc12)N/N=C\c(cccc1)c1OCc(cc1)ccc1Cl |
| InChI | InChI=1S/C26H21ClN2O2S/c27-22-14-12-19(13-15-22)17-31-24-10-4-2-7-21(24)16-28-29-26(30)18-32-25-11-5-8-20-6-1-3-9-23(20)25/h1-16H,17-18H2,(H,29,30) |
| InChIK | OOVSWAQXDQICJV-UHFFFAOYSA-N |
| TotalMolweight | 460.984 |
| Molweight | 460.984 |
| MonoisotopicMass | 460.101225 |
| CLogP | 6.5629 |
| CLogS | -7.946 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 351.78 |
| Relative PSA | 0.18051 |
| PolarSurfaceArea | 75.99 |
| Druglikeness | 4.4844 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.625 |
| Fragments | 1 |
| Non HAtoms | 32 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 8 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| StereoCon |
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