(2Z)-2-(2-morpholin-4-yl-2-oxoethoxy)imino-N-(4-nitrophenyl)acetamide
Formula:C14H16N4O6
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(2Z)-2-(2-morpholin-4-yl-2-oxoethoxy)imino-N-(4-nitrophenyl)acetamide is a drug-like molecule.
| MolName | (2Z)-2-(2-morpholin-4-yl-2-oxoethoxy)imino-N-(4-nitrophenyl)acetamide |
| MolecularFormula | C14H16N4O6 |
| Smiles | [O-][N+](c(cc1)ccc1NC(/C=N\OCC(N1CCOCC1)=O)=O)=O |
| InChI | InChI=1S/C14H16N4O6/c19-13(16-11-1-3-12(4-2-11)18(21)22)9-15-24-10-14(20)17-5-7-23-8-6-17/h1-4,9H,5-8,10H2,(H,16,19) |
| InChIK | CXTUSYZVYMHUCY-UHFFFAOYSA-N |
| TotalMolweight | 336.303 |
| Molweight | 336.303 |
| MonoisotopicMass | 336.106986 |
| CLogP | -0.5534 |
| CLogS | -1.977 |
| H Acceptors | 10 |
| H Donors | 1 |
| TotalSurfaceArea | 254.25 |
| Relative PSA | 0.40519 |
| PolarSurfaceArea | 126.05 |
| Druglikeness | -0.73275 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | aromatic nitro |
| Shape Index | 0.70833 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 10 |
| Electronegative Atoms | 10 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 8 |
| Symmetricatoms | 4 |
| Amides | 2 |
| AcidicOxygens | 1 |
| StereoCon |
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