N-(3-cyano-4,5-diphenylfuran-2-yl)-2-[(Z)-thiophen-2-ylmethylideneamino]oxyacetamide
Formula:C24H17N3O3S
Mutagenic:low
Tumorigenic:none
Reproductive Effective:high
N-(3-cyano-4,5-diphenylfuran-2-yl)-2-[(Z)-thiophen-2-ylmethylideneamino]oxyacetamide is not a drug-like molecule.
| MolName | N-(3-cyano-4,5-diphenylfuran-2-yl)-2-[(Z)-thiophen-2-ylmethylideneamino]oxyacetamide |
| MolecularFormula | C24H17N3O3S |
| Smiles | N#Cc1c(NC(CO/N=C\c2cccs2)=O)oc(-c2ccccc2)c1-c1ccccc1 |
| InChI | InChI=1S/C24H17N3O3S/c25-14-20-22(17-8-3-1-4-9-17)23(18-10-5-2-6-11-18)30-24(20)27-21(28)16-29-26-15-19-12-7-13-31-19/h1-13,15H,16H2,(H,27,28) |
| InChIK | QLEUAUCXSXUIOE-UHFFFAOYSA-N |
| TotalMolweight | 427.483 |
| Molweight | 427.483 |
| MonoisotopicMass | 427.099062 |
| CLogP | 5.8077 |
| CLogS | -8.423 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 337.61 |
| Relative PSA | 0.27855 |
| PolarSurfaceArea | 115.86 |
| Druglikeness | 0.32081 |
| Mutagenic | low |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.51613 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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1 - N-(3-cyano-4,5-diphenylfuran-2-yl)-2-[(Z)-thiophen-2-ylmethylideneamino]oxyacetamide | 2 - N-(3-cyano-4,5-diphenylfuran-2-yl)-2-[(Z)-thiophen-2-ylmethylideneamino]oxyacetamide
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