TL;DR: CTK4B4763 (CAS 125826-60-0) is a chemical compound with molecular formula C15H24N2O3 and molecular weight 280.17868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl (1S,6S)-2-(methoxyiminomethyl)-9-azabicyclo[4.2.1]non-2-ene-9-carboxylate
Also Known As: tert-Butyl (1S,6S)-5-((Z)-methoxyiminomethyl)-9-azabicyclo(4.2.1)non-4-ene-9-carboxylate, 9-Azabicyclo(4.2.1)non-2-ene-9-carboxylic acid, 2-((methoxyimino)methyl)-, 1,1-dimethylethyl ester, (1R-(1alpha,2(E),6alpha))-, 9-Azabicyclo[4.2.1]non-2-ene-9-carboxylicacid, 2-[(methoxyimino)methyl]-, 1,1-dimethylethyl ester, [1R-[1a,2(Z),6a]]- (9CI), 9-Azabicyclo[4.2.1]non-2-ene-9-carboxylicacid, 2-[(methoxyimino)methyl]-, 1,1-dimethylethylester, [1R-[1a,2(E),6a]]- (9CI)
| Molecular Formula | C15H24N2O3 |
| Molecular Weight | 280.17868 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 51.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.17868 Da |
| Heavy Atoms | 20 |
| Complexity | 423.0 |
| SMILES | CC(C)(C)OC(=O)N1[C@H]2CCC=C([C@@H]1CC2)C=NOC |
| InChIKey | BPYBFVSTYLQWHO-STQMWFEESA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK4B4763. With a topological polar surface area (TPSA) of 51.1 Ų, CTK4B4763 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CTK4B4763 has 0 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 CTK4B4763 is 125826-60-0.
The molecular formula of CTK4B4763 is C15H24N2O3.
The molecular weight of CTK4B4763 is 280.17868 g/mol.
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