(2Z)-2-[[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Formula:C23H14N2O2ClFS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(2Z)-2-[[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one is not a drug-like molecule.
| MolName | (2Z)-2-[[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one |
| MolecularFormula | C23H14N2O2ClFS |
| Smiles | O=C(/C(/S1)=C/c(cc2)ccc2OCc(c(F)ccc2)c2Cl)n2c1nc1c2cccc1 |
| InChI | InChI=1S/C23H14ClFN2O2S/c24-17-4-3-5-18(25)16(17)13-29-15-10-8-14(9-11-15)12-21-22(28)27-20-7-2-1-6-19(20)26-23(27)30-21/h1-12H,13H2 |
| InChIK | KYOOUOQKDDLFSK-UHFFFAOYSA-N |
| TotalMolweight | 436.893 |
| Molweight | 436.893 |
| MonoisotopicMass | 436.044853 |
| CLogP | 5.5611 |
| CLogS | -6.526 |
| H Acceptors | 4 |
| TotalSurfaceArea | 307.32 |
| Relative PSA | 0.18993 |
| PolarSurfaceArea | 69.42 |
| Druglikeness | 1.8546 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 2 |
| StereoCon |
Click to Load Molecule:
1 - (2Z)-2-[[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one | 2 - (2Z)-2-[[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
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