N'-(4-chlorophenyl)sulfonyl-N-[(4-hydroxybenzoyl)amino]benzenecarboximidamide
Formula:C20H16N3O4ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(4-chlorophenyl)sulfonyl-N-[(4-hydroxybenzoyl)amino]benzenecarboximidamide is a drug-like molecule.
| MolName | N'-(4-chlorophenyl)sulfonyl-N-[(4-hydroxybenzoyl)amino]benzenecarboximidamide |
| MolecularFormula | C20H16N3O4ClS |
| Smiles | Oc(cc1)ccc1C(NN/C(/c1ccccc1)=N/S(c(cc1)ccc1Cl)(=O)=O)=O |
| InChI | InChI=1S/C20H16ClN3O4S/c21-16-8-12-18(13-9-16)29(27,28)24-19(14-4-2-1-3-5-14)22-23-20(26)15-6-10-17(25)11-7-15/h1-13,25H,(H,22,24)(H,23,26) |
| InChIK | VBDANWUZLHAQRD-UHFFFAOYSA-N |
| TotalMolweight | 429.883 |
| Molweight | 429.883 |
| MonoisotopicMass | 429.055004 |
| CLogP | 3.0805 |
| CLogS | -4.842 |
| H Acceptors | 7 |
| H Donors | 3 |
| TotalSurfaceArea | 306.77 |
| Relative PSA | 0.29061 |
| PolarSurfaceArea | 116.24 |
| Druglikeness | 4.7048 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.55172 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 7 |
| BasicNitrogens | 1 |
| StereoCon |
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