N-[(Z)-[3-(furan-2-ylmethyl)-4-oxo-1,3-thiazolidin-2-ylidene]amino]-2-phenoxyacetamide
Formula:C16H15N3O4S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[3-(furan-2-ylmethyl)-4-oxo-1,3-thiazolidin-2-ylidene]amino]-2-phenoxyacetamide is a drug-like molecule.
| MolName | N-[(Z)-[3-(furan-2-ylmethyl)-4-oxo-1,3-thiazolidin-2-ylidene]amino]-2-phenoxyacetamide |
| MolecularFormula | C16H15N3O4S |
| Smiles | O=C(COc1ccccc1)N/N=C(/N1Cc2ccco2)\SCC1=O |
| InChI | InChI=1S/C16H15N3O4S/c20-14(10-23-12-5-2-1-3-6-12)17-18-16-19(15(21)11-24-16)9-13-7-4-8-22-13/h1-8H,9-11H2,(H,17,20) |
| InChIK | HXEGENCREGRATA-UHFFFAOYSA-N |
| TotalMolweight | 345.378 |
| Molweight | 345.378 |
| MonoisotopicMass | 345.078327 |
| CLogP | 1.4193 |
| CLogS | -3.523 |
| H Acceptors | 7 |
| H Donors | 1 |
| TotalSurfaceArea | 258.21 |
| Relative PSA | 0.36482 |
| PolarSurfaceArea | 109.44 |
| Druglikeness | 5.5966 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.625 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 5 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - N-[(Z)-[3-(furan-2-ylmethyl)-4-oxo-1,3-thiazolidin-2-ylidene]amino]-2-phenoxyacetamide | 2 - N-[(Z)-[3-(furan-2-ylmethyl)-4-oxo-1,3-thiazolidin-2-ylidene]amino]-2-phenoxyacetamide
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