(3Z)-3-[(4-chlorophenyl)methoxyimino]-1-(2-phenyl-1,3-thiazol-5-yl)propan-1-one
Formula:C19H15N2O2ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3Z)-3-[(4-chlorophenyl)methoxyimino]-1-(2-phenyl-1,3-thiazol-5-yl)propan-1-one is a drug-like molecule.
| MolName | (3Z)-3-[(4-chlorophenyl)methoxyimino]-1-(2-phenyl-1,3-thiazol-5-yl)propan-1-one |
| MolecularFormula | C19H15N2O2ClS |
| Smiles | O=C(C/C=N\OCc(cc1)ccc1Cl)c1cnc(-c2ccccc2)s1 |
| InChI | InChI=1S/C19H15ClN2O2S/c20-16-8-6-14(7-9-16)13-24-22-11-10-17(23)18-12-21-19(25-18)15-4-2-1-3-5-15/h1-9,11-12H,10,13H2 |
| InChIK | OGRQXSHZAFVCFI-UHFFFAOYSA-N |
| TotalMolweight | 370.859 |
| Molweight | 370.859 |
| MonoisotopicMass | 370.054275 |
| CLogP | 4.4323 |
| CLogS | -5.153 |
| H Acceptors | 4 |
| TotalSurfaceArea | 282.93 |
| Relative PSA | 0.23285 |
| PolarSurfaceArea | 79.79 |
| Druglikeness | 2.9631 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.72 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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