| MolName | (2-morpholin-4-yl-2-oxoethyl) 2-(4-bromophenoxy)acetate |
| MolecularFormula | C14H16NO5Br |
| Smiles | O=C(COC(COc(cc1)ccc1Br)=O)N1CCOCC1 |
| InChI | InChI=1S/C14H16BrNO5/c15-11-1-3-12(4-2-11)20-10-14(18)21-9-13(17)16-5-7-19-8-6-16/h1-4H,5-10H2 |
| InChIK | ZVXCSYSBSDOBGI-UHFFFAOYSA-N |
| TotalMolweight | 358.187 |
| Molweight | 358.187 |
| MonoisotopicMass | 357.021185 |
| CLogP | 1.1919 |
| CLogS | -1.843 |
| H Acceptors | 6 |
| TotalSurfaceArea | 236.75 |
| Relative PSA | 0.25187 |
| PolarSurfaceArea | 65.07 |
| Druglikeness | 2.0723 |
| Mutagenic | low |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 9 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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1 - (2-morpholin-4-yl-2-oxoethyl) 2-(4-bromophenoxy)acetate | 2 - (2-morpholin-4-yl-2-oxoethyl) 2-(4-bromophenoxy)acetate