BRN 1523590
TL;DR: BRN 1523590 (CAS 26090-50-6) is a chemical compound with molecular formula C33H34I6N4O8 and molecular weight 1375.6646 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[[9-[3-carboxy-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]anilino]-9-oxononanoyl]amino]-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]benzoic acid
Also Known As: 5-21-06-00379 (Beilstein Handbook Reference), Benzoic acid, 3,3'-(azelaoyldiimino)bis(5-((2-oxo-1-pyrrolidinyl)methyl)-2,4,6-triiodo-, 3,3'-(Azelaoyldiimino)bis(5-((2-oxo-1-pyrrolidinyl)methyl)-2,4,6-triiodobenzoic acid), 3,3 -(Azelaoyldiimino)bis[5-[(2-oxo-1-pyrrolidinyl)methyl]-2,4,6-triiodobenzoic acid], 3,3'-[(1,9-Dioxononane-1,9-diyl)bis(azanediyl)]bis{2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]benzoic acid}
Technical Specifications
| Molecular Formula | C33H34I6N4O8 |
| Molecular Weight | 1375.6646 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 173.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 16 |
| Exact Mass | 1375.6646 Da |
| Heavy Atoms | 51 |
| Complexity | 1210.0 |
| SMILES | C1CC(=O)N(C1)CC2=C(C(=C(C(=C2I)NC(=O)CCCCCCCC(=O)NC3=C(C(=C(C(=C3I)C(=O)O)I)CN4CCCC4=O)I)I)C(=O)O)I |
| InChIKey | UIXGQHGQJYKCFU-UHFFFAOYSA-N |
Chemical Property Profile of BRN 1523590
Property Insights of BRN 1523590
The XLogP value of 5.9 indicates that BRN 1523590 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 173.0 Ų indicates high polarity, suggesting BRN 1523590 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BRN 1523590 has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of BRN 1523590?
The CAS number of BRN 1523590 is 26090-50-6.
What is the molecular formula of BRN 1523590?
The molecular formula of BRN 1523590 is C33H34I6N4O8.
What is the molecular weight of BRN 1523590?
The molecular weight of BRN 1523590 is 1375.6646 g/mol.
Where can I buy BRN 1523590?
You can request a quote for BRN 1523590 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BRN 1523590?
Yes, CoreyChem provides custom synthesis services for BRN 1523590 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.