| MolName | 4-(4-fluorophenyl)-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-1,3-thiazol-2-amine |
| MolecularFormula | C23H18N3OFS |
| Smiles | Fc(cc1)ccc1-c1csc(N/N=C/c(cc2)ccc2OCc2ccccc2)n1 |
| InChI | InChI=1S/C23H18FN3OS/c24-20-10-8-19(9-11-20)22-16-29-23(26-22)27-25-14-17-6-12-21(13-7-17)28-15-18-4-2-1-3-5-18/h1-14,16H,15H2,(H,26,27) |
| InChIK | OJCIEGHSUYSKLO-UHFFFAOYSA-N |
| TotalMolweight | 403.48 |
| Molweight | 403.48 |
| MonoisotopicMass | 403.11546 |
| CLogP | 7.6653 |
| CLogS | -6.315 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 313.57 |
| Relative PSA | 0.20506 |
| PolarSurfaceArea | 74.75 |
| Druglikeness | 2.1705 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.72414 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Sp3Atoms | 2 |
| Symmetricatoms | 6 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - 4-(4-fluorophenyl)-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-1,3-thiazol-2-amine | 2 - 4-(4-fluorophenyl)-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-1,3-thiazol-2-amine