TL;DR: 1-(3-Acetyl-4-anilino-6-hydroxy-6-methyl-2-phenylcyclohex-3-en-1-yl)ethanone (CAS 161265-85-6) is a chemical compound with molecular formula C23H25NO3 and molecular weight 363.18344 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-acetyl-4-anilino-6-hydroxy-6-methyl-2-phenylcyclohex-3-en-1-yl)ethanone
Also Known As: 1-(3-acetyl-4-anilino-6-hydroxy-6-methyl-2-phenylcyclohex-3-en-1-yl)ethanone, 1,1'-[6-hydroxy-6-methyl-2-phenyl-4-(phenylamino)cyclohex-3-ene-1,3-diyl]diethanone, 1-(3-acetyl-4-anilino-6-hydroxy-6-methyl-2-phenyl-3-cyclohexen-1-yl)ethanone, 1-(5-Acetyl-4-hydroxy-4-methyl-6-phenyl-2-phenylamino-cyclohex-1-enyl)-ethanone, 1,1'-(3-hydroxy-3-methyl-5-(phenylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-diyl)diethanone
| Molecular Formula | C23H25NO3 |
| Molecular Weight | 363.18344 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.18344 Da |
| Heavy Atoms | 27 |
| Complexity | 599.0 |
| SMILES | CC(=O)C1C(C(=C(CC1(C)O)NC2=CC=CC=C2)C(=O)C)C3=CC=CC=C3 |
| InChIKey | FEAUWCGFLYHOEV-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that 1-(3-Acetyl-4-anilino-6-hydroxy-6-methyl-2-phenylcyclohex-3-en-1-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Acetyl-4-anilino-6-hydroxy-6-methyl-2-phenylcyclohex-3-en-1-yl)ethanone. Following Lipinski's Rule of Five, 1-(3-Acetyl-4-anilino-6-hydroxy-6-methyl-2-phenylcyclohex-3-en-1-yl)ethanone has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(3-Acetyl-4-anilino-6-hydroxy-6-methyl-2-phenylcyclohex-3-en-1-yl)ethanone is 161265-85-6.
The molecular formula of 1-(3-Acetyl-4-anilino-6-hydroxy-6-methyl-2-phenylcyclohex-3-en-1-yl)ethanone is C23H25NO3.
The molecular weight of 1-(3-Acetyl-4-anilino-6-hydroxy-6-methyl-2-phenylcyclohex-3-en-1-yl)ethanone is 363.18344 g/mol.
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