| MolName | 2-[N-(benzenesulfonyl)-2-methylanilino]-N-(5-chloro-2-methoxyphenyl)acetamide |
| MolecularFormula | C22H21N2O4ClS |
| Smiles | Cc(cccc1)c1N(CC(Nc(cc(cc1)Cl)c1OC)=O)S(c1ccccc1)(=O)=O |
| InChI | InChI=1S/C22H21ClN2O4S/c1-16-8-6-7-11-20(16)25(30(27,28)18-9-4-3-5-10-18)15-22(26)24-19-14-17(23)12-13-21(19)29-2/h3-14H,15H2,1-2H3,(H,24,26) |
| InChIK | MECPYIPMBSCVPU-UHFFFAOYSA-N |
| TotalMolweight | 444.938 |
| Molweight | 444.938 |
| MonoisotopicMass | 444.091055 |
| CLogP | 3.5362 |
| CLogS | -5.431 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 324.57 |
| Relative PSA | 0.20529 |
| PolarSurfaceArea | 84.09 |
| Druglikeness | -1.8994 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.43333 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 5 |
| Symmetricatoms | 3 |
| Amides | 2 |
| StereoCon |
Click to Load Molecule:
1 - 2-[N-(benzenesulfonyl)-2-methylanilino]-N-(5-chloro-2-methoxyphenyl)acetamide | 2 - 2-[N-(benzenesulfonyl)-2-methylanilino]-N-(5-chloro-2-methoxyphenyl)acetamide