(NZ)-N-[3,4-dihydro-2H-quinolin-1-yl(phenyl)methylidene]thiophene-2-sulfonamide
Formula:C20H18N2O2S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[3,4-dihydro-2H-quinolin-1-yl(phenyl)methylidene]thiophene-2-sulfonamide is a drug-like molecule.
| MolName | (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl(phenyl)methylidene]thiophene-2-sulfonamide |
| MolecularFormula | C20H18N2O2S2 |
| Smiles | O=S(c1cccs1)(/N=C(/c1ccccc1)\N(CCC1)c2c1cccc2)=O |
| InChI | InChI=1S/C20H18N2O2S2/c23-26(24,19-13-7-15-25-19)21-20(17-9-2-1-3-10-17)22-14-6-11-16-8-4-5-12-18(16)22/h1-5,7-10,12-13,15H,6,11,14H2 |
| InChIK | LUPZDHPOWIMUKE-UHFFFAOYSA-N |
| TotalMolweight | 382.507 |
| Molweight | 382.507 |
| MonoisotopicMass | 382.080968 |
| CLogP | 4.7276 |
| CLogS | -4.732 |
| H Acceptors | 4 |
| TotalSurfaceArea | 278.35 |
| Relative PSA | 0.22993 |
| PolarSurfaceArea | 86.36 |
| Druglikeness | 3.6286 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.42308 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 4 |
| Symmetricatoms | 3 |
| BasicNitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl(phenyl)methylidene]thiophene-2-sulfonamide | 2 - (NZ)-N-[3,4-dihydro-2H-quinolin-1-yl(phenyl)methylidene]thiophene-2-sulfonamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off