(2Z)-2-(1,3-benzothiazol-2-yl)-2-(pyridin-3-ylhydrazinylidene)acetamide
Formula:C14H11N5OS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(2Z)-2-(1,3-benzothiazol-2-yl)-2-(pyridin-3-ylhydrazinylidene)acetamide is a drug-like molecule.
| MolName | (2Z)-2-(1,3-benzothiazol-2-yl)-2-(pyridin-3-ylhydrazinylidene)acetamide |
| MolecularFormula | C14H11N5OS |
| Smiles | NC(/C(/c1nc(cccc2)c2s1)=N/Nc1cnccc1)=O |
| InChI | InChI=1S/C14H11N5OS/c15-13(20)12(19-18-9-4-3-7-16-8-9)14-17-10-5-1-2-6-11(10)21-14/h1-8,18H,(H2,15,20) |
| InChIK | HNXSCSLMIHGZJY-UHFFFAOYSA-N |
| TotalMolweight | 297.341 |
| Molweight | 297.341 |
| MonoisotopicMass | 297.06843 |
| CLogP | 2.111 |
| CLogS | -2.529 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 221.78 |
| Relative PSA | 0.42195 |
| PolarSurfaceArea | 121.5 |
| Druglikeness | 3.8205 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| Amides | 1 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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