3-carbazol-9-yl-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]propanamide
Formula:C24H21N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
3-carbazol-9-yl-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]propanamide is a drug-like molecule.
| MolName | 3-carbazol-9-yl-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]propanamide |
| MolecularFormula | C24H21N3O |
| Smiles | O=C(CCn1c(cccc2)c2c2c1cccc2)N/N=C\C=C\c1ccccc1 |
| InChI | InChI=1S/C24H21N3O/c28-24(26-25-17-8-11-19-9-2-1-3-10-19)16-18-27-22-14-6-4-12-20(22)21-13-5-7-15-23(21)27/h1-15,17H,16,18H2,(H,26,28) |
| InChIK | KJPXZMOXQQJBKS-UHFFFAOYSA-N |
| TotalMolweight | 367.451 |
| Molweight | 367.451 |
| MonoisotopicMass | 367.168462 |
| CLogP | 4.658 |
| CLogS | -5.439 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 299.41 |
| Relative PSA | 0.14321 |
| PolarSurfaceArea | 46.39 |
| Druglikeness | 6.0974 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.60714 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 19 |
| Sp3Atoms | 2 |
| Symmetricatoms | 8 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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