| MolName | N-[(Z)-(2-chloro-1,3-thiazol-5-yl)methylideneamino]furan-2-carboxamide |
| MolecularFormula | C9H6N3O2ClS |
| Smiles | O=C(c1ccco1)N/N=C\c(s1)cnc1Cl |
| InChI | InChI=1S/C9H6ClN3O2S/c10-9-11-4-6(16-9)5-12-13-8(14)7-2-1-3-15-7/h1-5H,(H,13,14) |
| InChIK | OMYGIJHKJBUEAL-UHFFFAOYSA-N |
| TotalMolweight | 255.685 |
| Molweight | 255.685 |
| MonoisotopicMass | 254.986924 |
| CLogP | 2.4033 |
| CLogS | -3.851 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 186.8 |
| Relative PSA | 0.43603 |
| PolarSurfaceArea | 95.73 |
| Druglikeness | 5.3327 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.6875 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 10 |
| Aromatic Nitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - N-[(Z)-(2-chloro-1,3-thiazol-5-yl)methylideneamino]furan-2-carboxamide | 2 - N-[(Z)-(2-chloro-1,3-thiazol-5-yl)methylideneamino]furan-2-carboxamide