N'-(benzenesulfonyl)-N-(3-bromo-4-hydroxyphenyl)benzenecarboximidamide
Formula:C19H15N2O3BrS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(benzenesulfonyl)-N-(3-bromo-4-hydroxyphenyl)benzenecarboximidamide is a drug-like molecule.
| MolName | N'-(benzenesulfonyl)-N-(3-bromo-4-hydroxyphenyl)benzenecarboximidamide |
| MolecularFormula | C19H15N2O3BrS |
| Smiles | Oc(ccc(N/C(/c1ccccc1)=N/S(c1ccccc1)(=O)=O)c1)c1Br |
| InChI | InChI=1S/C19H15BrN2O3S/c20-17-13-15(11-12-18(17)23)21-19(14-7-3-1-4-8-14)22-26(24,25)16-9-5-2-6-10-16/h1-13,23H,(H,21,22) |
| InChIK | JBISGLFKHFHSHZ-UHFFFAOYSA-N |
| TotalMolweight | 431.309 |
| Molweight | 431.309 |
| MonoisotopicMass | 429.998674 |
| CLogP | 4.3892 |
| CLogS | -4.758 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 280.77 |
| Relative PSA | 0.23026 |
| PolarSurfaceArea | 87.14 |
| Druglikeness | -8.3071 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 5 |
| BasicNitrogens | 1 |
| StereoCon |
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