4-chloro-N'-(4-chlorophenyl)sulfonylbenzenecarboximidamide
Formula:C13H10N2O2Cl2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-chloro-N'-(4-chlorophenyl)sulfonylbenzenecarboximidamide is a drug-like molecule.
| MolName | 4-chloro-N'-(4-chlorophenyl)sulfonylbenzenecarboximidamide |
| MolecularFormula | C13H10N2O2Cl2S |
| Smiles | N/C(/c(cc1)ccc1Cl)=N\S(c(cc1)ccc1Cl)(=O)=O |
| InChI | InChI=1S/C13H10Cl2N2O2S/c14-10-3-1-9(2-4-10)13(16)17-20(18,19)12-7-5-11(15)6-8-12/h1-8H,(H2,16,17) |
| InChIK | FUUHWOIGRQUJPU-UHFFFAOYSA-N |
| TotalMolweight | 329.206 |
| Molweight | 329.206 |
| MonoisotopicMass | 327.984002 |
| CLogP | 3.1615 |
| CLogS | -4.269 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 223.93 |
| Relative PSA | 0.24722 |
| PolarSurfaceArea | 80.9 |
| Druglikeness | 2.1339 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 5 |
| BasicNitrogens | 1 |
| StereoCon |
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