N-[(Z)-(1-benzylbenzimidazol-2-yl)methylideneamino]benzamide
Formula:C22H18N4O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(1-benzylbenzimidazol-2-yl)methylideneamino]benzamide is a drug-like molecule.
| MolName | N-[(Z)-(1-benzylbenzimidazol-2-yl)methylideneamino]benzamide |
| MolecularFormula | C22H18N4O |
| Smiles | O=C(c1ccccc1)N/N=C\c1nc(cccc2)c2n1Cc1ccccc1 |
| InChI | InChI=1S/C22H18N4O/c27-22(18-11-5-2-6-12-18)25-23-15-21-24-19-13-7-8-14-20(19)26(21)16-17-9-3-1-4-10-17/h1-15H,16H2,(H,25,27) |
| InChIK | AXLXDEHBSBQIIB-UHFFFAOYSA-N |
| TotalMolweight | 354.412 |
| Molweight | 354.412 |
| MonoisotopicMass | 354.148061 |
| CLogP | 4.181 |
| CLogS | -3.669 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 283.07 |
| Relative PSA | 0.19024 |
| PolarSurfaceArea | 59.28 |
| Druglikeness | 5.9645 |
| 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 | 21 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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