TL;DR: beta-Alanine, N-(2,2,6,6-tetramethyl-4-piperidinyl)-, dodecyl ester (CAS 119530-69-7) is a chemical compound with molecular formula C24H48N2O2 and molecular weight 396.37158 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dodecyl 3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]propanoate
Also Known As: 2-Chloro-2',3'-dideoxydidehydroadenosine, .beta.-Alanine, N-(2,2,6,6-tetramethyl-4-piperidinyl)-, dodecyl ester, beta-Alanine, N-(2,2,6,6-tetramethyl-4-piperidinyl)-, dodecyl ester, dodecyl 3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]propanoate, J1.053.267A
| Molecular Formula | C24H48N2O2 |
| Molecular Weight | 396.37158 g/mol |
| XLogP | 7.1 |
| Topological Polar Surface Area (TPSA) | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 396.37158 Da |
| Heavy Atoms | 28 |
| Complexity | 405.0 |
| SMILES | CCCCCCCCCCCCOC(=O)CCNC1CC(NC(C1)(C)C)(C)C |
| InChIKey | HBFNPDZOVCWRLE-UHFFFAOYSA-N |
The XLogP value of 7.1 indicates that beta-Alanine, N-(2,2,6,6-tetramethyl-4-piperidinyl)-, dodecyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.4 Ų, beta-Alanine, N-(2,2,6,6-tetramethyl-4-piperidinyl)-, dodecyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Alanine, N-(2,2,6,6-tetramethyl-4-piperidinyl)-, dodecyl ester has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of beta-Alanine, N-(2,2,6,6-tetramethyl-4-piperidinyl)-, dodecyl ester is 119530-69-7.
The molecular formula of beta-Alanine, N-(2,2,6,6-tetramethyl-4-piperidinyl)-, dodecyl ester is C24H48N2O2.
The molecular weight of beta-Alanine, N-(2,2,6,6-tetramethyl-4-piperidinyl)-, dodecyl ester is 396.37158 g/mol.
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