![2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid structure](/static/products/5439/54390-57-7.webp)
2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid
TL;DR: 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid (CAS 54390-57-7) is a chemical compound with molecular formula C44H52N12O16S4 and molecular weight 1132.2507 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[[4-[bis(2-hydroxypropyl)amino]-6-(4-sulfoanilino)-1,3,5-triazin-2-yl]amino]-2-[2-[4-[[4-[bis(2-hydroxypropyl)amino]-6-(4-sulfoanilino)-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]ethenyl]benzenesulfonic acid
Also Known As: 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C44H52N12O16S4 |
| Molecular Weight | 1132.2507 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 464.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 28 |
| Rotatable Bonds | 24 |
| Exact Mass | 1132.2507 Da |
| Heavy Atoms | 76 |
| Complexity | 2120.0 |
| SMILES | CC(CN(CC(C)O)C1=NC(=NC(=N1)NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=C(C=C5)S(=O)(=O)O)N(CC(C)O)CC(C)O)S(=O)(=O)O)S(=O)(=O)O)NC6=CC=C(C=C6)S(=O)(=O)O)O |
| InChIKey | WCHNJMNABRPWNP-UHFFFAOYSA-N |
Chemical Property Profile of 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid
Property Insights of 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid. The TPSA of 464.0 Ų indicates high polarity, suggesting 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid has 12 hydrogen bond donor(s) and 28 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid?
The CAS number of 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid is 54390-57-7.
What is the molecular formula of 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid?
The molecular formula of 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid is C44H52N12O16S4.
What is the molecular weight of 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid?
The molecular weight of 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid is 1132.2507 g/mol.
Where can I buy 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid?
You can request a quote for 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid?
Yes, CoreyChem provides custom synthesis services for 2,2a(2)-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxypropyl)amino]-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]benzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.