N'-(2,4-difluorophenyl)sulfonyl-N-(4-piperidin-1-ylsulfonylphenyl)benzenecarboximidamide
Formula:C24H23N3O4F2S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(2,4-difluorophenyl)sulfonyl-N-(4-piperidin-1-ylsulfonylphenyl)benzenecarboximidamide is not a drug-like molecule.
| MolName | N'-(2,4-difluorophenyl)sulfonyl-N-(4-piperidin-1-ylsulfonylphenyl)benzenecarboximidamide |
| MolecularFormula | C24H23N3O4F2S2 |
| Smiles | O=S(c(cc1)ccc1N/C(/c1ccccc1)=N/S(c(ccc(F)c1)c1F)(=O)=O)(N1CCCCC1)=O |
| InChI | InChI=1S/C24H23F2N3O4S2/c25-19-9-14-23(22(26)17-19)34(30,31)28-24(18-7-3-1-4-8-18)27-20-10-12-21(13-11-20)35(32,33)29-15-5-2-6-16-29/h1,3-4,7-14,17H,2,5-6,15-16H2,(H,27,28) |
| InChIK | PKMOIPZLOYQCEJ-UHFFFAOYSA-N |
| TotalMolweight | 519.592 |
| Molweight | 519.592 |
| MonoisotopicMass | 519.109803 |
| CLogP | 4.4181 |
| CLogS | -4.943 |
| H Acceptors | 7 |
| H Donors | 1 |
| TotalSurfaceArea | 362.67 |
| Relative PSA | 0.23073 |
| PolarSurfaceArea | 112.67 |
| Druglikeness | 0.74388 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.51429 |
| Fragments | 1 |
| Non HAtoms | 35 |
| NonCHAtoms | 11 |
| Electronegative Atoms | 11 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 7 |
| Symmetricatoms | 8 |
| Amides | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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