(4Z)-4-benzylidene-2-phenyl-1,3-thiazolidin-5-one
Formula:C16H13NOS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(4Z)-4-benzylidene-2-phenyl-1,3-thiazolidin-5-one is a drug-like molecule.
| MolName | (4Z)-4-benzylidene-2-phenyl-1,3-thiazolidin-5-one |
| MolecularFormula | C16H13NOS |
| Smiles | O=C1SC(c2ccccc2)N/C1=C\c1ccccc1 |
| InChI | InChI=1S/C16H13NOS/c18-16-14(11-12-7-3-1-4-8-12)17-15(19-16)13-9-5-2-6-10-13/h1-11,15,17H/t15-/m0/s1 |
| InChIK | JKIIOFOLMSPCAU-HNNXBMFYSA-N |
| TotalMolweight | 267.351 |
| Molweight | 267.351 |
| MonoisotopicMass | 267.071784 |
| CLogP | 2.8961 |
| CLogS | -3.109 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 203.43 |
| Relative PSA | 0.20641 |
| PolarSurfaceArea | 54.4 |
| Druglikeness | 2.0624 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.63158 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| BasicNitrogens | 1 |
| StereoCon | racemate |
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1 - (4Z)-4-benzylidene-2-phenyl-1,3-thiazolidin-5-one | 2 - (4Z)-4-benzylidene-2-phenyl-1,3-thiazolidin-5-one
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