neo-Truxilline
TL;DR: neo-Truxilline (CAS 128210-64-0) is a chemical compound with molecular formula C38H46N2O8 and molecular weight 658.32544 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis[(1R,2R,5S)-2-methoxycarbonyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (1S,2S,3S,4R)-3,4-diphenylcyclobutane-1,2-dicarboxylate
Also Known As: neo-Truxilline, 3,4-diphenylcyclobuten-1,2-dione, bis[(1R,2R,5S)-2-methoxycarbonyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (1S,2S,3R,4S)-3,4-diphenylcyclobutane-1,2-dicarboxylate, 1,2-Cyclobutanedicarboxylicacid, 3,4-diphenyl-,bis[(1R,2R,3S,5S)-2-(methoxycarbonyl)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl]ester, (1S,2S,3S,4R)- (9CI), bis[(1r,2r,5s)-2-(methoxycarbonyl)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl](1s,2s,3r,4s)-3,4-diphenylcyclobutane-1,2-dicarboxylate
Technical Specifications
| Molecular Formula | C38H46N2O8 |
| Molecular Weight | 658.32544 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 658.32544 Da |
| Heavy Atoms | 48 |
| Complexity | 1120.0 |
| SMILES | CN1[C@H]2CC[C@@H]1[C@H](C(C2)OC(=O)[C@H]3[C@@H]([C@@H]([C@@H]3C(=O)OC4C[C@@H]5CC[C@H]([C@H]4C(=O)OC)N5C)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)OC |
| InChIKey | SYSWFFZJNZSEIZ-INQOXXOWSA-N |
Chemical Property Profile of neo-Truxilline
Property Insights of neo-Truxilline
The XLogP value of 4.6 indicates that neo-Truxilline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for neo-Truxilline. Following Lipinski's Rule of Five, neo-Truxilline has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of neo-Truxilline?
The CAS number of neo-Truxilline is 128210-64-0.
What is the molecular formula of neo-Truxilline?
The molecular formula of neo-Truxilline is C38H46N2O8.
What is the molecular weight of neo-Truxilline?
The molecular weight of neo-Truxilline is 658.32544 g/mol.
Where can I buy neo-Truxilline?
You can request a quote for neo-Truxilline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for neo-Truxilline?
Yes, CoreyChem provides custom synthesis services for neo-Truxilline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.