2-[benzenesulfonyl(furan-2-ylmethyl)amino]-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide
Formula:C19H18N4O4S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[benzenesulfonyl(furan-2-ylmethyl)amino]-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide is a drug-like molecule.
| MolName | 2-[benzenesulfonyl(furan-2-ylmethyl)amino]-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide |
| MolecularFormula | C19H18N4O4S |
| Smiles | O=C(CN(Cc1ccco1)S(c1ccccc1)(=O)=O)N/N=C\c1cnccc1 |
| InChI | InChI=1S/C19H18N4O4S/c24-19(22-21-13-16-6-4-10-20-12-16)15-23(14-17-7-5-11-27-17)28(25,26)18-8-2-1-3-9-18/h1-13H,14-15H2,(H,22,24) |
| InChIK | XOEGZRTVOVJANO-UHFFFAOYSA-N |
| TotalMolweight | 398.442 |
| Molweight | 398.442 |
| MonoisotopicMass | 398.104876 |
| CLogP | 1.671 |
| CLogS | -2.832 |
| H Acceptors | 8 |
| H Donors | 1 |
| TotalSurfaceArea | 301.6 |
| Relative PSA | 0.30908 |
| PolarSurfaceArea | 113.25 |
| Druglikeness | -0.31509 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.53571 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 3 |
| Symmetricatoms | 3 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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