2-[benzenesulfonyl(benzyl)amino]-N-[(Z)-benzylideneamino]acetamide
Formula:C22H21N3O3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[benzenesulfonyl(benzyl)amino]-N-[(Z)-benzylideneamino]acetamide is a drug-like molecule.
| MolName | 2-[benzenesulfonyl(benzyl)amino]-N-[(Z)-benzylideneamino]acetamide |
| MolecularFormula | C22H21N3O3S |
| Smiles | O=C(CN(Cc1ccccc1)S(c1ccccc1)(=O)=O)N/N=C\c1ccccc1 |
| InChI | InChI=1S/C22H21N3O3S/c26-22(24-23-16-19-10-4-1-5-11-19)18-25(17-20-12-6-2-7-13-20)29(27,28)21-14-8-3-9-15-21/h1-16H,17-18H2,(H,24,26) |
| InChIK | FQPDPOZSIXKPPM-UHFFFAOYSA-N |
| TotalMolweight | 407.493 |
| Molweight | 407.493 |
| MonoisotopicMass | 407.130362 |
| CLogP | 3.4832 |
| CLogS | -3.945 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 313.15 |
| Relative PSA | 0.2176 |
| PolarSurfaceArea | 87.22 |
| Druglikeness | -0.51853 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.51724 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 7 |
| Amides | 1 |
| StereoCon |
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1 - 2-[benzenesulfonyl(benzyl)amino]-N-[(Z)-benzylideneamino]acetamide | 2 - 2-[benzenesulfonyl(benzyl)amino]-N-[(Z)-benzylideneamino]acetamide
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