N'-(benzenesulfonyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzenecarboximidamide
Formula:C20H16N4O3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(benzenesulfonyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzenecarboximidamide is a drug-like molecule.
| MolName | N'-(benzenesulfonyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzenecarboximidamide |
| MolecularFormula | C20H16N4O3S |
| Smiles | O=C1Nc(cc(cc2)N/C(/c3ccccc3)=N/S(c3ccccc3)(=O)=O)c2N1 |
| InChI | InChI=1S/C20H16N4O3S/c25-20-22-17-12-11-15(13-18(17)23-20)21-19(14-7-3-1-4-8-14)24-28(26,27)16-9-5-2-6-10-16/h1-13H,(H,21,24)(H2,22,23,25) |
| InChIK | MEOQGZMSAZYESR-UHFFFAOYSA-N |
| TotalMolweight | 392.438 |
| Molweight | 392.438 |
| MonoisotopicMass | 392.094311 |
| CLogP | 2.9014 |
| CLogS | -5.162 |
| H Acceptors | 7 |
| H Donors | 3 |
| TotalSurfaceArea | 282.96 |
| Relative PSA | 0.30927 |
| PolarSurfaceArea | 108.04 |
| Druglikeness | -6.3358 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 5 |
| Amides | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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