BW A522
TL;DR: BW A522 (CAS 112537-41-4) is a chemical compound with molecular formula C23H22IN5O5 and molecular weight 575.0666 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[3-[(4-amino-3-iodophenyl)methyl]-2,6-dioxo-1-propyl-7H-purin-8-yl]phenoxy]acetic acid
Also Known As: I-Abopx, BW A522, BW-A522, GTPL446, KST-1B0110
Technical Specifications
| Molecular Formula | C23H22IN5O5 |
| Molecular Weight | 575.0666 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 142.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 575.0666 Da |
| Heavy Atoms | 34 |
| Complexity | 764.0 |
| SMILES | CCCN1C(=O)C2=C(N=C(N2)C3=CC=C(C=C3)OCC(=O)O)N(C1=O)CC4=CC(=C(C=C4)N)I |
| InChIKey | DKJMGIXWGPEEFF-UHFFFAOYSA-N |
Chemical Property Profile of BW A522
Property Insights of BW A522
The XLogP value of 4.4 indicates that BW A522 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.0 Ų indicates high polarity, suggesting BW A522 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BW A522 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of BW A522?
The CAS number of BW A522 is 112537-41-4.
What is the molecular formula of BW A522?
The molecular formula of BW A522 is C23H22IN5O5.
What is the molecular weight of BW A522?
The molecular weight of BW A522 is 575.0666 g/mol.
Where can I buy BW A522?
You can request a quote for BW A522 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BW A522?
Yes, CoreyChem provides custom synthesis services for BW A522 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.