N'-(benzenesulfonyl)-N-pyridin-3-ylbenzenecarboximidamide
Formula:C18H15N3O2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(benzenesulfonyl)-N-pyridin-3-ylbenzenecarboximidamide is a drug-like molecule.
| MolName | N'-(benzenesulfonyl)-N-pyridin-3-ylbenzenecarboximidamide |
| MolecularFormula | C18H15N3O2S |
| Smiles | O=S(c1ccccc1)(/N=C(\c1ccccc1)/Nc1cnccc1)=O |
| InChI | InChI=1S/C18H15N3O2S/c22-24(23,17-11-5-2-6-12-17)21-18(15-8-3-1-4-9-15)20-16-10-7-13-19-14-16/h1-14H,(H,20,21) |
| InChIK | NRWVMNQCNMGLFG-UHFFFAOYSA-N |
| TotalMolweight | 337.402 |
| Molweight | 337.402 |
| MonoisotopicMass | 337.088497 |
| CLogP | 3.0088 |
| CLogS | -3.425 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 254.55 |
| Relative PSA | 0.24561 |
| PolarSurfaceArea | 79.8 |
| Druglikeness | -5.4329 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 5 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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