4-amino-N-(8-chloroquinolin-5-yl)benzenesulfonamide
Formula:C15H12N3O2ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-amino-N-(8-chloroquinolin-5-yl)benzenesulfonamide is a drug-like molecule.
| MolName | 4-amino-N-(8-chloroquinolin-5-yl)benzenesulfonamide |
| MolecularFormula | C15H12N3O2ClS |
| Smiles | Nc(cc1)ccc1S(Nc(c1cccnc11)ccc1Cl)(=O)=O |
| InChI | InChI=1S/C15H12ClN3O2S/c16-13-7-8-14(12-2-1-9-18-15(12)13)19-22(20,21)11-5-3-10(17)4-6-11/h1-9,19H,17H2 |
| InChIK | AIHHJXHJUMZFRP-UHFFFAOYSA-N |
| TotalMolweight | 333.798 |
| Molweight | 333.798 |
| MonoisotopicMass | 333.033874 |
| CLogP | 2.2034 |
| CLogS | -4.467 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 230.36 |
| Relative PSA | 0.28772 |
| PolarSurfaceArea | 93.46 |
| Druglikeness | 3.4101 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.54545 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 1 |
| Symmetricatoms | 3 |
| Amides | 1 |
| Amines | 1 |
| Aromatic Amines | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - 4-amino-N-(8-chloroquinolin-5-yl)benzenesulfonamide | 2 - 4-amino-N-(8-chloroquinolin-5-yl)benzenesulfonamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off