| MolName | N'-(4-fluorophenyl)sulfonyl-N-(4-phenyl-1,3-thiazol-2-yl)benzenecarboximidamide |
| MolecularFormula | C22H16N3O2FS2 |
| Smiles | O=S(c(cc1)ccc1F)(/N=C(\c1ccccc1)/Nc1nc(-c2ccccc2)cs1)=O |
| InChI | InChI=1S/C22H16FN3O2S2/c23-18-11-13-19(14-12-18)30(27,28)26-21(17-9-5-2-6-10-17)25-22-24-20(15-29-22)16-7-3-1-4-8-16/h1-15H,(H,24,25,26) |
| InChIK | QKLHCVAOMOLMPS-UHFFFAOYSA-N |
| TotalMolweight | 437.518 |
| Molweight | 437.518 |
| MonoisotopicMass | 437.066795 |
| CLogP | 5.486 |
| CLogS | -6.045 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 316.6 |
| Relative PSA | 0.26178 |
| PolarSurfaceArea | 108.04 |
| Druglikeness | 0.93733 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | limit! thiazol-2-ylamine |
| Shape Index | 0.53333 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Sp3Atoms | 1 |
| Symmetricatoms | 7 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - N'-(4-fluorophenyl)sulfonyl-N-(4-phenyl-1,3-thiazol-2-yl)benzenecarboximidamide | 2 - N'-(4-fluorophenyl)sulfonyl-N-(4-phenyl-1,3-thiazol-2-yl)benzenecarboximidamide