compound 48/80
TL;DR: compound 48/80 (CAS 94724-12-6) is a chemical compound with molecular formula C32H45N3O3 and molecular weight 519.34607 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-methoxy-3-[[2-methoxy-3-[[2-methoxy-5-[2-(methylamino)ethyl]phenyl]methyl]-5-[2-(methylamino)ethyl]phenyl]methyl]phenyl]-N-methylethanamine
Also Known As: compound 48/80, Compound 48/80 (trimer), Compound 48/80 trihydrochloride, Benzenediazonium,2-carboxy-,chloride, oligomer portion of compound 48/80
Technical Specifications
| Molecular Formula | C32H45N3O3 |
| Molecular Weight | 519.34607 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 63.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Exact Mass | 519.34607 Da |
| Heavy Atoms | 38 |
| Complexity | 577.0 |
| SMILES | CNCCC1=CC(=C(C=C1)OC)CC2=CC(=CC(=C2OC)CC3=C(C=CC(=C3)CCNC)OC)CCNC |
| InChIKey | DXEVTBAWIGXNAW-UHFFFAOYSA-N |
Chemical Property Profile of compound 48/80
Property Insights of compound 48/80
The XLogP value of 5.2 indicates that compound 48/80 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.8 Ų falls within the moderate polarity range, balancing permeability and solubility for compound 48/80. Following Lipinski's Rule of Five, compound 48/80 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of compound 48/80?
The CAS number of compound 48/80 is 94724-12-6.
What is the molecular formula of compound 48/80?
The molecular formula of compound 48/80 is C32H45N3O3.
What is the molecular weight of compound 48/80?
The molecular weight of compound 48/80 is 519.34607 g/mol.
Where can I buy compound 48/80?
You can request a quote for compound 48/80 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for compound 48/80?
Yes, CoreyChem provides custom synthesis services for compound 48/80 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.