| MolName | N-[(Z)-(3,5-diphenylcyclohex-2-en-1-ylidene)amino]-4-phenylquinazolin-2-amine |
| MolecularFormula | C32H26N4 |
| Smiles | C(C(CC(c1ccccc1)=C1)c2ccccc2)/C1=N/Nc1nc2ccccc2c(-c2ccccc2)n1 |
| InChI | InChI=1S/C32H26N4/c1-4-12-23(13-5-1)26-20-27(24-14-6-2-7-15-24)22-28(21-26)35-36-32-33-30-19-11-10-18-29(30)31(34-32)25-16-8-3-9-17-25/h1-19,21,27H,20,22H2,(H,33,34,36)/t27-/m0/s1 |
| InChIK | UANWCBVTRMVOLV-MHZLTWQESA-N |
| TotalMolweight | 466.586 |
| Molweight | 466.586 |
| MonoisotopicMass | 466.215746 |
| CLogP | 9.1892 |
| CLogS | -7.519 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 370.32 |
| Relative PSA | 0.12127 |
| PolarSurfaceArea | 50.17 |
| Druglikeness | 1.7275 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.44444 |
| Fragments | 1 |
| Non HAtoms | 36 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| StereoCenters | 1 |
| Rotatable Bond | 5 |
| Rings Closures | 6 |
| Small Rings | 6 |
| Aromatic Rings | 5 |
| Aromatic Atoms | 28 |
| Sp3Atoms | 3 |
| Symmetricatoms | 6 |
| Aromatic Nitrogens | 2 |
| StereoCon | racemate |
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1 - N-[(Z)-(3,5-diphenylcyclohex-2-en-1-ylidene)amino]-4-phenylquinazolin-2-amine | 2 - N-[(Z)-(3,5-diphenylcyclohex-2-en-1-ylidene)amino]-4-phenylquinazolin-2-amine