TL;DR: Trisnorsqualene N-methylcyclopropylamine (CAS 123594-77-4) is a chemical compound with molecular formula C31H53N and molecular weight 439.4178 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-methyl-N-[(4Z,8Z,12Z,16Z)-4,8,13,17,21-pentamethyldocosa-4,8,12,16,20-pentaenyl]cyclopropanamine
Also Known As: Trisnorsqualene nmca, Trisnorsqualene N-methylcyclopropylamine, N-methyl-N-[(4Z,8Z,12Z,16Z)-4,8,13,17,21-pentamethyldocosa-4,8,12,16,20-pentaenyl]cyclopropanamine, Cyclopropanamine, N-methyl-N-(4,8,13,17,21-pentamethyl-4,8,12,16,20-docosapentaenyl)-, (all-E)-
| Molecular Formula | C31H53N |
| Molecular Weight | 439.4178 g/mol |
| XLogP | 10.6 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 17 |
| Exact Mass | 439.4178 Da |
| Heavy Atoms | 32 |
| Complexity | 663.0 |
| SMILES | CC(=CCC/C(=C\CC/C(=C\CC/C=C(/C)\CC/C=C(/C)\CCCN(C)C1CC1)/C)/C)C |
| InChIKey | DWHRGDDPNGNRRM-LKNHTZMTSA-N |
The XLogP value of 10.6 indicates that Trisnorsqualene N-methylcyclopropylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Trisnorsqualene N-methylcyclopropylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trisnorsqualene N-methylcyclopropylamine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Trisnorsqualene N-methylcyclopropylamine is 123594-77-4.
The molecular formula of Trisnorsqualene N-methylcyclopropylamine is C31H53N.
The molecular weight of Trisnorsqualene N-methylcyclopropylamine is 439.4178 g/mol.
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