4-chloro-N-[(E)-2,3-dihydroinden-1-ylideneamino]benzamide
Formula:C16H13N2OCl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-chloro-N-[(E)-2,3-dihydroinden-1-ylideneamino]benzamide is a drug-like molecule.
| MolName | 4-chloro-N-[(E)-2,3-dihydroinden-1-ylideneamino]benzamide |
| MolecularFormula | C16H13N2OCl |
| Smiles | O=C(c(cc1)ccc1Cl)N/N=C(\CC1)/c2c1cccc2 |
| InChI | InChI=1S/C16H13ClN2O/c17-13-8-5-12(6-9-13)16(20)19-18-15-10-7-11-3-1-2-4-14(11)15/h1-6,8-9H,7,10H2,(H,19,20) |
| InChIK | GWSFSKQEQRJQSY-UHFFFAOYSA-N |
| TotalMolweight | 284.745 |
| Molweight | 284.745 |
| MonoisotopicMass | 284.07164 |
| CLogP | 4.1383 |
| CLogS | -5.136 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 214.64 |
| Relative PSA | 0.16777 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | 2.4039 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - 4-chloro-N-[(E)-2,3-dihydroinden-1-ylideneamino]benzamide | 2 - 4-chloro-N-[(E)-2,3-dihydroinden-1-ylideneamino]benzamide
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