TL;DR: methyl (2E,4E,6E,8E)-2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoate (CAS 1164507-19-0) is a chemical compound with molecular formula C16H24N2O3 and molecular weight 292.17868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2E,4E,6E,8E)-2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoate
Also Known As: methyl (2E,4E,6E,8E)-2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoate, (2E,4E,6E,8E)-2-Acetyl-3,9-bis-dimethylamino-nona-2,4,6,8-tetraenoic acid methyl ester, (2E,4E,6E,8E)-2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoic acid methyl ester, (2E,4E,6E,8E)-methyl 2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoate, methyl (2E,4E,6E,8E)-3,9-bis(dimethylamino)-2-ethanoyl-nona-2,4,6,8-tetraenoate
| Molecular Formula | C16H24N2O3 |
| Molecular Weight | 292.17868 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 49.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 292.17868 Da |
| Heavy Atoms | 21 |
| Complexity | 484.0 |
| SMILES | CC(=O)/C(=C(/C=C/C=C/C=C/N(C)C)\N(C)C)/C(=O)OC |
| InChIKey | MZZYBAIUIOHQLA-USJRQALFSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (2E,4E,6E,8E)-2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoate. With a topological polar surface area (TPSA) of 49.9 Ų, methyl (2E,4E,6E,8E)-2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl (2E,4E,6E,8E)-2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of methyl (2E,4E,6E,8E)-2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoate is 1164507-19-0.
The molecular formula of methyl (2E,4E,6E,8E)-2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoate is C16H24N2O3.
The molecular weight of methyl (2E,4E,6E,8E)-2-acetyl-3,9-bis(dimethylamino)nona-2,4,6,8-tetraenoate is 292.17868 g/mol.
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