| MolName | (Z)-3-thiophen-2-yl-N-[6-[[(Z)-3-thiophen-2-ylprop-2-enoyl]amino]pyridin-2-yl]prop-2-enamide |
| MolecularFormula | C19H15N3O2S2 |
| Smiles | O=C(/C=C\c1cccs1)Nc1cccc(NC(/C=C\c2cccs2)=O)n1 |
| InChI | InChI=1S/C19H15N3O2S2/c23-18(10-8-14-4-2-12-25-14)21-16-6-1-7-17(20-16)22-19(24)11-9-15-5-3-13-26-15/h1-13H,(H2,20,21,22,23,24) |
| InChIK | JWYIVJUJWDLXNP-UHFFFAOYSA-N |
| TotalMolweight | 381.479 |
| Molweight | 381.479 |
| MonoisotopicMass | 381.060567 |
| CLogP | 4.0481 |
| CLogS | -5.655 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 294.84 |
| Relative PSA | 0.34151 |
| PolarSurfaceArea | 127.57 |
| Druglikeness | 1.6538 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65385 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Symmetricatoms | 12 |
| Amides | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - (Z)-3-thiophen-2-yl-N-[6-[[(Z)-3-thiophen-2-ylprop-2-enoyl]amino]pyridin-2-yl]prop-2-enamide | 2 - (Z)-3-thiophen-2-yl-N-[6-[[(Z)-3-thiophen-2-ylprop-2-enoyl]amino]pyridin-2-yl]prop-2-enamide