(E)-N-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-3-phenylprop-2-enamide
Formula:C23H20N2O3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-3-phenylprop-2-enamide is a drug-like molecule.
| MolName | (E)-N-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-3-phenylprop-2-enamide |
| MolecularFormula | C23H20N2O3S |
| Smiles | O=C(/C=C/c1ccccc1)Nc(cc1)ccc1S(N(CC1)c2c1cccc2)(=O)=O |
| InChI | InChI=1S/C23H20N2O3S/c26-23(15-10-18-6-2-1-3-7-18)24-20-11-13-21(14-12-20)29(27,28)25-17-16-19-8-4-5-9-22(19)25/h1-15H,16-17H2,(H,24,26) |
| InChIK | COYJOMOHUJKLRB-UHFFFAOYSA-N |
| TotalMolweight | 404.489 |
| Molweight | 404.489 |
| MonoisotopicMass | 404.119463 |
| CLogP | 3.7529 |
| CLogS | -5.29 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 301.39 |
| Relative PSA | 0.1879 |
| PolarSurfaceArea | 74.86 |
| Druglikeness | 3.4465 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.62069 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 5 |
| Amides | 2 |
| StereoCon |
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