(E)-N-cycloheptyl-2-phenylethenesulfonamide
Formula:C15H21NO2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N-cycloheptyl-2-phenylethenesulfonamide is a drug-like molecule.
| MolName | (E)-N-cycloheptyl-2-phenylethenesulfonamide |
| MolecularFormula | C15H21NO2S |
| Smiles | O=S(/C=C/c1ccccc1)(NC1CCCCCC1)=O |
| InChI | InChI=1S/C15H21NO2S/c17-19(18,13-12-14-8-4-3-5-9-14)16-15-10-6-1-2-7-11-15/h3-5,8-9,12-13,15-16H,1-2,6-7,10-11H2 |
| InChIK | JVXRWUDXLWDMID-UHFFFAOYSA-N |
| TotalMolweight | 279.403 |
| Molweight | 279.403 |
| MonoisotopicMass | 279.129299 |
| CLogP | 3.2086 |
| CLogS | -4.443 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 221.36 |
| Relative PSA | 0.18088 |
| PolarSurfaceArea | 54.55 |
| Druglikeness | -4.2897 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.63158 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 8 |
| Symmetricatoms | 6 |
| Amides | 1 |
| StereoCon |
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1 - (E)-N-cycloheptyl-2-phenylethenesulfonamide | 2 - (E)-N-cycloheptyl-2-phenylethenesulfonamide
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