N-[(2-fluorophenyl)methylsulfamoyl]-1-(4-methylphenyl)methanamine
Formula:C15H17N2O2FS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(2-fluorophenyl)methylsulfamoyl]-1-(4-methylphenyl)methanamine is a drug-like molecule.
| MolName | N-[(2-fluorophenyl)methylsulfamoyl]-1-(4-methylphenyl)methanamine |
| MolecularFormula | C15H17N2O2FS |
| Smiles | Cc1ccc(CNS(NCc(cccc2)c2F)(=O)=O)cc1 |
| InChI | InChI=1S/C15H17FN2O2S/c1-12-6-8-13(9-7-12)10-17-21(19,20)18-11-14-4-2-3-5-15(14)16/h2-9,17-18H,10-11H2,1H3 |
| InChIK | NELHUZGQELEXII-UHFFFAOYSA-N |
| TotalMolweight | 308.376 |
| Molweight | 308.376 |
| MonoisotopicMass | 308.099476 |
| CLogP | 2.58 |
| CLogS | -3.674 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 230.65 |
| Relative PSA | 0.22328 |
| PolarSurfaceArea | 66.58 |
| Druglikeness | -1.3452 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 4 |
| Symmetricatoms | 3 |
| Amides | 2 |
| StereoCon |
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