| MolName | N-[4-[[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]sulfamoyl]phenyl]acetamide |
| MolecularFormula | C22H20N4O3S |
| Smiles | CC(Nc(cc1)ccc1S(Nc1cc(-c2cn(cccc3C)c3n2)ccc1)(=O)=O)=O |
| InChI | InChI=1S/C22H20N4O3S/c1-15-5-4-12-26-14-21(24-22(15)26)17-6-3-7-19(13-17)25-30(28,29)20-10-8-18(9-11-20)23-16(2)27/h3-14,25H,1-2H3,(H,23,27) |
| InChIK | DYBJQZQWBQEMAQ-UHFFFAOYSA-N |
| TotalMolweight | 420.492 |
| Molweight | 420.492 |
| MonoisotopicMass | 420.125611 |
| CLogP | 2.699 |
| CLogS | -6.694 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 310.56 |
| Relative PSA | 0.26874 |
| PolarSurfaceArea | 100.95 |
| Druglikeness | 6.4153 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.56667 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Sp3Atoms | 3 |
| Symmetricatoms | 3 |
| Amides | 2 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - N-[4-[[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]sulfamoyl]phenyl]acetamide | 2 - N-[4-[[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]sulfamoyl]phenyl]acetamide