(NZ)-N-[(5Z)-4-oxo-5-(pyridin-3-ylmethylidene)-1,3-thiazolidin-2-ylidene]benzenesulfonamide
Formula:C15H11N3O3S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(5Z)-4-oxo-5-(pyridin-3-ylmethylidene)-1,3-thiazolidin-2-ylidene]benzenesulfonamide is a drug-like molecule.
| MolName | (NZ)-N-[(5Z)-4-oxo-5-(pyridin-3-ylmethylidene)-1,3-thiazolidin-2-ylidene]benzenesulfonamide |
| MolecularFormula | C15H11N3O3S2 |
| Smiles | O=C(/C(/S1)=C/c2cnccc2)N/C1=N/S(c1ccccc1)(=O)=O |
| InChI | InChI=1S/C15H11N3O3S2/c19-14-13(9-11-5-4-8-16-10-11)22-15(17-14)18-23(20,21)12-6-2-1-3-7-12/h1-10H,(H,17,18,19) |
| InChIK | RSYDPBQSNWRHDG-UHFFFAOYSA-N |
| TotalMolweight | 345.402 |
| Molweight | 345.402 |
| MonoisotopicMass | 345.024182 |
| CLogP | 1.6911 |
| CLogS | -3.446 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 241.24 |
| Relative PSA | 0.38572 |
| PolarSurfaceArea | 122.17 |
| Druglikeness | -3.07 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6087 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 3 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (NZ)-N-[(5Z)-4-oxo-5-(pyridin-3-ylmethylidene)-1,3-thiazolidin-2-ylidene]benzenesulfonamide | 2 - (NZ)-N-[(5Z)-4-oxo-5-(pyridin-3-ylmethylidene)-1,3-thiazolidin-2-ylidene]benzenesulfonamide
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