2-[benzyl(methylsulfonyl)amino]-N-(4-propan-2-ylphenyl)acetamide
Formula:C19H24N2O3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[benzyl(methylsulfonyl)amino]-N-(4-propan-2-ylphenyl)acetamide is a drug-like molecule.
| MolName | 2-[benzyl(methylsulfonyl)amino]-N-(4-propan-2-ylphenyl)acetamide |
| MolecularFormula | C19H24N2O3S |
| Smiles | CC(C)c(cc1)ccc1NC(CN(Cc1ccccc1)S(C)(=O)=O)=O |
| InChI | InChI=1S/C19H24N2O3S/c1-15(2)17-9-11-18(12-10-17)20-19(22)14-21(25(3,23)24)13-16-7-5-4-6-8-16/h4-12,15H,13-14H2,1-3H3,(H,20,22) |
| InChIK | KOPHEQUWWFEMGR-UHFFFAOYSA-N |
| TotalMolweight | 360.477 |
| Molweight | 360.477 |
| MonoisotopicMass | 360.150763 |
| CLogP | 3.0253 |
| CLogS | -3.977 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 277.91 |
| Relative PSA | 0.20377 |
| PolarSurfaceArea | 74.86 |
| Druglikeness | 2.8162 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 7 |
| Symmetricatoms | 6 |
| Amides | 2 |
| StereoCon |
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