N'-(4-chlorophenyl)sulfonyl-N-naphthalen-2-ylbenzenecarboximidamide
Formula:C23H17N2O2ClS
Mutagenic:low
Tumorigenic:high
Reproductive Effective:none
N'-(4-chlorophenyl)sulfonyl-N-naphthalen-2-ylbenzenecarboximidamide is not a drug-like molecule.
| MolName | N'-(4-chlorophenyl)sulfonyl-N-naphthalen-2-ylbenzenecarboximidamide |
| MolecularFormula | C23H17N2O2ClS |
| Smiles | O=S(c(cc1)ccc1Cl)(/N=C(/c1ccccc1)\Nc1cc2ccccc2cc1)=O |
| InChI | InChI=1S/C23H17ClN2O2S/c24-20-11-14-22(15-12-20)29(27,28)26-23(18-7-2-1-3-8-18)25-21-13-10-17-6-4-5-9-19(17)16-21/h1-16H,(H,25,26) |
| InChIK | OOYDCKLKNUXBRI-UHFFFAOYSA-N |
| TotalMolweight | 420.919 |
| Molweight | 420.919 |
| MonoisotopicMass | 420.069925 |
| CLogP | 5.8101 |
| CLogS | -6.562 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 305.81 |
| Relative PSA | 0.16857 |
| PolarSurfaceArea | 66.91 |
| Druglikeness | 0.38431 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.51724 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 1 |
| Symmetricatoms | 5 |
| BasicNitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - N'-(4-chlorophenyl)sulfonyl-N-naphthalen-2-ylbenzenecarboximidamide | 2 - N'-(4-chlorophenyl)sulfonyl-N-naphthalen-2-ylbenzenecarboximidamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off