N-(2-chlorophenyl)-2-[(3Z)-3-[3-[(2-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetamide
Formula:C26H17N3O3Cl2S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-(2-chlorophenyl)-2-[(3Z)-3-[3-[(2-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetamide is not a drug-like molecule.
| MolName | N-(2-chlorophenyl)-2-[(3Z)-3-[3-[(2-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetamide |
| MolecularFormula | C26H17N3O3Cl2S2 |
| Smiles | O=C(CN(c(cccc1)c1/C1=C(\C(N2Cc(cccc3)c3Cl)=O)/SC2=S)C1=O)Nc(cccc1)c1Cl |
| InChI | InChI=1S/C26H17Cl2N3O3S2/c27-17-9-3-1-7-15(17)13-31-25(34)23(36-26(31)35)22-16-8-2-6-12-20(16)30(24(22)33)14-21(32)29-19-11-5-4-10-18(19)28/h1-12H,13-14H2,(H,29,32) |
| InChIK | YIKIRPNLFWSENZ-UHFFFAOYSA-N |
| TotalMolweight | 554.477 |
| Molweight | 554.477 |
| MonoisotopicMass | 553.008836 |
| CLogP | 3.577 |
| CLogS | -6.8 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 382.57 |
| Relative PSA | 0.26968 |
| PolarSurfaceArea | 127.11 |
| Druglikeness | 5.3411 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | low |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 36 |
| NonCHAtoms | 10 |
| Electronegative Atoms | 10 |
| Rotatable Bond | 5 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Amides | 3 |
| StereoCon |
Click to Load Molecule:
1 - N-(2-chlorophenyl)-2-[(3Z)-3-[3-[(2-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetamide | 2 - N-(2-chlorophenyl)-2-[(3Z)-3-[3-[(2-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]acetamide
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