(+)-16alpha-Acetoxynorbuxabenzamidienine
TL;DR: (+)-16alpha-Acetoxynorbuxabenzamidienine (CAS 126025-06-7) is a chemical compound with molecular formula C34H48N2O3 and molecular weight 532.3665 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[6-benzamido-7,7,12,16-tetramethyl-15-[1-(methylamino)ethyl]-14-tetracyclo[9.7.0.03,8.012,16]octadeca-1(18),2-dienyl] acetate
Also Known As: (+)-16alpha-Acetoxynorbuxabenzamidienine, (+)-Nor-16alpha-acetoxybuxabenzamidienine, ( )-16alpha-Acetoxynorbuxabenzamidienine, ( )-Nor-16alpha-acetoxybuxabenzamidienine, N-[16-(Acetyloxy)-4,4,14-trimethyl-20-(methylamino)-9,19-cyclo-9,10-secopregna-9(11),10-dien-3-yl]benzenecarboximidic acid
Technical Specifications
| Molecular Formula | C34H48N2O3 |
| Molecular Weight | 532.3665 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 532.3665 Da |
| Heavy Atoms | 39 |
| Complexity | 1020.0 |
| SMILES | CC(C1C(CC2(C1(CC=C3C2CCC4C(=C3)CCC(C4(C)C)NC(=O)C5=CC=CC=C5)C)C)OC(=O)C)NC |
| InChIKey | PAYBPGDQZXJNMH-UHFFFAOYSA-N |
Chemical Property Profile of (+)-16alpha-Acetoxynorbuxabenzamidienine
Property Insights of (+)-16alpha-Acetoxynorbuxabenzamidienine
The XLogP value of 6.2 indicates that (+)-16alpha-Acetoxynorbuxabenzamidienine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (+)-16alpha-Acetoxynorbuxabenzamidienine. Following Lipinski's Rule of Five, (+)-16alpha-Acetoxynorbuxabenzamidienine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (+)-16alpha-Acetoxynorbuxabenzamidienine?
The CAS number of (+)-16alpha-Acetoxynorbuxabenzamidienine is 126025-06-7.
What is the molecular formula of (+)-16alpha-Acetoxynorbuxabenzamidienine?
The molecular formula of (+)-16alpha-Acetoxynorbuxabenzamidienine is C34H48N2O3.
What is the molecular weight of (+)-16alpha-Acetoxynorbuxabenzamidienine?
The molecular weight of (+)-16alpha-Acetoxynorbuxabenzamidienine is 532.3665 g/mol.
Where can I buy (+)-16alpha-Acetoxynorbuxabenzamidienine?
You can request a quote for (+)-16alpha-Acetoxynorbuxabenzamidienine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (+)-16alpha-Acetoxynorbuxabenzamidienine?
Yes, CoreyChem provides custom synthesis services for (+)-16alpha-Acetoxynorbuxabenzamidienine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.