N'-(4-chlorophenyl)sulfonyl-N-(dianilinomethylidene)benzenecarboximidamide
Formula:C26H21N4O2ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(4-chlorophenyl)sulfonyl-N-(dianilinomethylidene)benzenecarboximidamide is not a drug-like molecule.
| MolName | N'-(4-chlorophenyl)sulfonyl-N-(dianilinomethylidene)benzenecarboximidamide |
| MolecularFormula | C26H21N4O2ClS |
| Smiles | O=S(c(cc1)ccc1Cl)(/N=C(/c1ccccc1)\N=C(Nc1ccccc1)Nc1ccccc1)=O |
| InChI | InChI=1S/C26H21ClN4O2S/c27-21-16-18-24(19-17-21)34(32,33)31-25(20-10-4-1-5-11-20)30-26(28-22-12-6-2-7-13-22)29-23-14-8-3-9-15-23/h1-19H,(H2,28,29,30,31) |
| InChIK | VUXQUSDLXJXFEC-UHFFFAOYSA-N |
| TotalMolweight | 488.998 |
| Molweight | 488.998 |
| MonoisotopicMass | 488.107373 |
| CLogP | 6.2365 |
| CLogS | -6.98 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 365.4 |
| Relative PSA | 0.20394 |
| PolarSurfaceArea | 91.3 |
| Druglikeness | 2.142 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.44118 |
| Fragments | 1 |
| Non HAtoms | 34 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 1 |
| Symmetricatoms | 14 |
| BasicNitrogens | 2 |
| StereoCon |
Click to Load Molecule:
1 - N'-(4-chlorophenyl)sulfonyl-N-(dianilinomethylidene)benzenecarboximidamide | 2 - N'-(4-chlorophenyl)sulfonyl-N-(dianilinomethylidene)benzenecarboximidamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off