N-(4-hydroxyphenyl)-2-(2-oxo-1,3-benzothiazol-3-yl)acetamide
Formula:C15H12N2O3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-(4-hydroxyphenyl)-2-(2-oxo-1,3-benzothiazol-3-yl)acetamide is a drug-like molecule.
| MolName | N-(4-hydroxyphenyl)-2-(2-oxo-1,3-benzothiazol-3-yl)acetamide |
| MolecularFormula | C15H12N2O3S |
| Smiles | Oc(cc1)ccc1NC(CN(c(cccc1)c1S1)C1=O)=O |
| InChI | InChI=1S/C15H12N2O3S/c18-11-7-5-10(6-8-11)16-14(19)9-17-12-3-1-2-4-13(12)21-15(17)20/h1-8,18H,9H2,(H,16,19) |
| InChIK | VOZNZFBKSXLFNE-UHFFFAOYSA-N |
| TotalMolweight | 300.337 |
| Molweight | 300.337 |
| MonoisotopicMass | 300.056863 |
| CLogP | 1.4696 |
| CLogS | -3.971 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 214.38 |
| Relative PSA | 0.33436 |
| PolarSurfaceArea | 94.94 |
| Druglikeness | 3.9764 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61905 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| Amides | 2 |
| StereoCon |
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1 - N-(4-hydroxyphenyl)-2-(2-oxo-1,3-benzothiazol-3-yl)acetamide | 2 - N-(4-hydroxyphenyl)-2-(2-oxo-1,3-benzothiazol-3-yl)acetamide
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