N'-(5H-chromeno[4,3-d]pyrimidin-2-yl)-N-[(4-fluorophenyl)methoxy]methanimidamide
Formula:C19H15N4O2F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(5H-chromeno[4,3-d]pyrimidin-2-yl)-N-[(4-fluorophenyl)methoxy]methanimidamide is a drug-like molecule.
| MolName | N'-(5H-chromeno[4,3-d]pyrimidin-2-yl)-N-[(4-fluorophenyl)methoxy]methanimidamide |
| MolecularFormula | C19H15N4O2F |
| Smiles | Fc1ccc(CON/C=N\c2nc(-c(cccc3)c3OC3)c3cn2)cc1 |
| InChI | InChI=1S/C19H15FN4O2/c20-15-7-5-13(6-8-15)10-26-23-12-22-19-21-9-14-11-25-17-4-2-1-3-16(17)18(14)24-19/h1-9,12H,10-11H2,(H,21,22,23,24) |
| InChIK | XPMALGPQQOSIBR-UHFFFAOYSA-N |
| TotalMolweight | 350.352 |
| Molweight | 350.352 |
| MonoisotopicMass | 350.117904 |
| CLogP | 2.0352 |
| CLogS | -5.062 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 266.89 |
| Relative PSA | 0.24321 |
| PolarSurfaceArea | 68.63 |
| Druglikeness | -1.907 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65385 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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