| MolName | 2-[2-[(E)-1-benzamido-2-phenylethenyl]-5-oxo-1,3-oxazolidin-4-yl]acetic acid |
| MolecularFormula | C20H18N2O5 |
| Smiles | OC(CC1NC(/C(/NC(c2ccccc2)=O)=C\c2ccccc2)OC1=O)=O |
| InChI | InChI=1S/C20H18N2O5/c23-17(24)12-16-20(26)27-19(22-16)15(11-13-7-3-1-4-8-13)21-18(25)14-9-5-2-6-10-14/h1-11,16,19,22H,12H2,(H,21,25)(H,23,24)/b15-11+ |
| InChIK | JSJKWEALTZCBIE-RVDMUPIBSA-N |
| TotalMolweight | 366.372 |
| Molweight | 366.372 |
| MonoisotopicMass | 366.121573 |
| CLogP | -0.0014997 |
| CLogS | -3.577 |
| H Acceptors | 7 |
| H Donors | 3 |
| TotalSurfaceArea | 275.51 |
| Relative PSA | 0.30903 |
| PolarSurfaceArea | 104.73 |
| Druglikeness | 3.5357 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.48148 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| StereoCenters | 2 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 4 |
| Amides | 1 |
| BasicNitrogens | 1 |
| AcidicOxygens | 1 |
| StereoCon | unknown chirality |
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1 - 2-[2-[(E)-1-benzamido-2-phenylethenyl]-5-oxo-1,3-oxazolidin-4-yl]acetic acid | 2 - 2-[2-[(E)-1-benzamido-2-phenylethenyl]-5-oxo-1,3-oxazolidin-4-yl]acetic acid