N-(3-chlorophenyl)-2-[2-[(E)-2-phenylethenyl]benzimidazol-1-yl]acetamide
Formula:C23H18N3OCl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-(3-chlorophenyl)-2-[2-[(E)-2-phenylethenyl]benzimidazol-1-yl]acetamide is a drug-like molecule.
| MolName | N-(3-chlorophenyl)-2-[2-[(E)-2-phenylethenyl]benzimidazol-1-yl]acetamide |
| MolecularFormula | C23H18N3OCl |
| Smiles | O=C(Cn1c(cccc2)c2nc1/C=C/c1ccccc1)Nc1cccc(Cl)c1 |
| InChI | InChI=1S/C23H18ClN3O/c24-18-9-6-10-19(15-18)25-23(28)16-27-21-12-5-4-11-20(21)26-22(27)14-13-17-7-2-1-3-8-17/h1-15H,16H2,(H,25,28) |
| InChIK | HTDCQNDARCJGRH-UHFFFAOYSA-N |
| TotalMolweight | 387.869 |
| Molweight | 387.869 |
| MonoisotopicMass | 387.113839 |
| CLogP | 4.7366 |
| CLogS | -4.625 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 300.23 |
| Relative PSA | 0.14103 |
| PolarSurfaceArea | 46.92 |
| Druglikeness | 3.3944 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.53571 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Amides | 1 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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