3-carbazol-9-yl-N-[(Z)-(2-fluorophenyl)methylideneamino]propanamide
Formula:C22H18N3OF
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
3-carbazol-9-yl-N-[(Z)-(2-fluorophenyl)methylideneamino]propanamide is a drug-like molecule.
| MolName | 3-carbazol-9-yl-N-[(Z)-(2-fluorophenyl)methylideneamino]propanamide |
| MolecularFormula | C22H18N3OF |
| Smiles | O=C(CCn1c(cccc2)c2c2c1cccc2)N/N=C\c(cccc1)c1F |
| InChI | InChI=1S/C22H18FN3O/c23-19-10-4-1-7-16(19)15-24-25-22(27)13-14-26-20-11-5-2-8-17(20)18-9-3-6-12-21(18)26/h1-12,15H,13-14H2,(H,25,27) |
| InChIK | JKTVOSBIHCJIHF-UHFFFAOYSA-N |
| TotalMolweight | 359.403 |
| Molweight | 359.403 |
| MonoisotopicMass | 359.14339 |
| CLogP | 4.7405 |
| CLogS | -5.461 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 279.26 |
| Relative PSA | 0.15355 |
| PolarSurfaceArea | 46.39 |
| Druglikeness | 4.7483 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.55556 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 19 |
| Sp3Atoms | 2 |
| Symmetricatoms | 6 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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