N'-(2,4-difluorophenyl)sulfonyl-N-pyridin-3-ylbenzenecarboximidamide
Formula:C18H13N3O2F2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(2,4-difluorophenyl)sulfonyl-N-pyridin-3-ylbenzenecarboximidamide is a drug-like molecule.
| MolName | N'-(2,4-difluorophenyl)sulfonyl-N-pyridin-3-ylbenzenecarboximidamide |
| MolecularFormula | C18H13N3O2F2S |
| Smiles | O=S(c(ccc(F)c1)c1F)(/N=C(\c1ccccc1)/Nc1cnccc1)=O |
| InChI | InChI=1S/C18H13F2N3O2S/c19-14-8-9-17(16(20)11-14)26(24,25)23-18(13-5-2-1-3-6-13)22-15-7-4-10-21-12-15/h1-12H,(H,22,23) |
| InChIK | DNWVYVRKFUIURN-UHFFFAOYSA-N |
| TotalMolweight | 373.382 |
| Molweight | 373.382 |
| MonoisotopicMass | 373.069653 |
| CLogP | 3.2104 |
| CLogS | -4.053 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 267.25 |
| Relative PSA | 0.23394 |
| PolarSurfaceArea | 79.8 |
| Druglikeness | 0.2645 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 3 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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