N-cyclohexyl-4-oxo-1-phenyl-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide
Formula:C24H26N2O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-cyclohexyl-4-oxo-1-phenyl-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide is a drug-like molecule.
| MolName | N-cyclohexyl-4-oxo-1-phenyl-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide |
| MolecularFormula | C24H26N2O2 |
| Smiles | O=C(C(CC1=O)(/C=C/c2ccccc2)N1c1ccccc1)NC1CCCCC1 |
| InChI | InChI=1S/C24H26N2O2/c27-22-18-24(17-16-19-10-4-1-5-11-19,26(22)21-14-8-3-9-15-21)23(28)25-20-12-6-2-7-13-20/h1,3-5,8-11,14-17,20H,2,6-7,12-13,18H2,(H,25,28)/t24-/m1/s1 |
| InChIK | AOIGFRCRSRUIGA-XMMPIXPASA-N |
| TotalMolweight | 374.482 |
| Molweight | 374.482 |
| MonoisotopicMass | 374.199428 |
| CLogP | 3.8712 |
| CLogS | -5.118 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 295.25 |
| Relative PSA | 0.13917 |
| PolarSurfaceArea | 49.41 |
| Druglikeness | -0.215 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.46429 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| StereoCenters | 1 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 8 |
| Symmetricatoms | 6 |
| Amides | 2 |
| StereoCon | racemate |
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1 - N-cyclohexyl-4-oxo-1-phenyl-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide | 2 - N-cyclohexyl-4-oxo-1-phenyl-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide
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