N-cyclohexyl-2-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]acetamide
Formula:C17H26N2O5S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-cyclohexyl-2-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]acetamide is a drug-like molecule.
| MolName | N-cyclohexyl-2-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]acetamide |
| MolecularFormula | C17H26N2O5S |
| Smiles | CN(CC(NC1CCCCC1)=O)S(c(cc1)cc(OC)c1OC)(=O)=O |
| InChI | InChI=1S/C17H26N2O5S/c1-19(12-17(20)18-13-7-5-4-6-8-13)25(21,22)14-9-10-15(23-2)16(11-14)24-3/h9-11,13H,4-8,12H2,1-3H3,(H,18,20) |
| InChIK | OPEWOYXMRATTQS-UHFFFAOYSA-N |
| TotalMolweight | 370.468 |
| Molweight | 370.468 |
| MonoisotopicMass | 370.156243 |
| CLogP | 1.3776 |
| CLogS | -2.132 |
| H Acceptors | 7 |
| H Donors | 1 |
| TotalSurfaceArea | 279.69 |
| Relative PSA | 0.27398 |
| PolarSurfaceArea | 93.32 |
| Druglikeness | 0.71451 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 13 |
| Symmetricatoms | 3 |
| Amides | 2 |
| StereoCon |
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1 - N-cyclohexyl-2-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]acetamide | 2 - N-cyclohexyl-2-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]acetamide
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