N'-(4-fluorophenyl)sulfonyl-N-pyridin-2-ylbenzenecarboximidamide
Formula:C18H14N3O2FS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(4-fluorophenyl)sulfonyl-N-pyridin-2-ylbenzenecarboximidamide is a drug-like molecule.
| MolName | N'-(4-fluorophenyl)sulfonyl-N-pyridin-2-ylbenzenecarboximidamide |
| MolecularFormula | C18H14N3O2FS |
| Smiles | O=S(c(cc1)ccc1F)(/N=C(/c1ccccc1)\Nc1ncccc1)=O |
| InChI | InChI=1S/C18H14FN3O2S/c19-15-9-11-16(12-10-15)25(23,24)22-18(14-6-2-1-3-7-14)21-17-8-4-5-13-20-17/h1-13H,(H,20,21,22) |
| InChIK | JHJJGCZZFXCPJT-UHFFFAOYSA-N |
| TotalMolweight | 355.392 |
| Molweight | 355.392 |
| MonoisotopicMass | 355.079075 |
| CLogP | 3.461 |
| CLogS | -4.264 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 260.9 |
| Relative PSA | 0.23963 |
| PolarSurfaceArea | 79.8 |
| Druglikeness | 0.0057836 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| 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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1 - N'-(4-fluorophenyl)sulfonyl-N-pyridin-2-ylbenzenecarboximidamide | 2 - N'-(4-fluorophenyl)sulfonyl-N-pyridin-2-ylbenzenecarboximidamide
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