N'-(4-iodophenyl)sulfonyl-N-phenylbenzenecarboximidamide
Formula:C19H15N2O2IS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(4-iodophenyl)sulfonyl-N-phenylbenzenecarboximidamide is a drug-like molecule.
| MolName | N'-(4-iodophenyl)sulfonyl-N-phenylbenzenecarboximidamide |
| MolecularFormula | C19H15N2O2IS |
| Smiles | O=S(c(cc1)ccc1I)(/N=C(\c1ccccc1)/Nc1ccccc1)=O |
| InChI | InChI=1S/C19H15IN2O2S/c20-16-11-13-18(14-12-16)25(23,24)22-19(15-7-3-1-4-8-15)21-17-9-5-2-6-10-17/h1-14H,(H,21,22) |
| InChIK | TXJHHZKBOLBMJQ-UHFFFAOYSA-N |
| TotalMolweight | 462.306 |
| Molweight | 462.306 |
| MonoisotopicMass | 461.989896 |
| CLogP | 4.4468 |
| CLogS | -5.236 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 282.07 |
| Relative PSA | 0.18276 |
| PolarSurfaceArea | 66.91 |
| Druglikeness | 1.0186 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 7 |
| BasicNitrogens | 1 |
| StereoCon |
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