RefChem:1078705
TL;DR: RefChem:1078705 (CAS 15208-16-9) is a chemical compound with molecular formula C30H40N12O10S2 and molecular weight 792.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-[bis(2-hydroxyethyl)amino]-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-[(E)-2-[4-[[4-[bis(2-hydroxyethyl)amino]-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]ethenyl]benzenesulfonic acid
Also Known As: Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-(bis(2-hydroxyethyl)amino)-6-(methylamino)-1,3,5-triazin-2-yl)amino)-, 2,2 -(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxyethyl)amino]-6-methylamino-1,3,5-triazin-2-yl]amino]benzenesulfonic acid], 2,2'-(1,2-Ethenediyl)bis[5-[[4-[bis(2-hydroxyethyl)amino]-6-methylamino-1,3,5-triazin-2-yl]amino]benzenesulfonic acid], 5-({4-[bis(2-hydroxyethyl)amino]-6-(methylamino)-1,3,5-triazin-2-yl}amino)-2-{2-[4-({4-[bis(2-hydroxyethyl)amino]-6-(methylamino)-1,3,5-triazin-2-yl}amino)-2-sulfophenyl]ethenyl}benzene-1-sulfonic acid, 5-[[4-[bis(2-hydroxyethyl)amino]-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-[(E)-2-[4-[[4-[bis(2-hydroxyethyl)amino]-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]ethenyl]benzenesulfonic acid
| Molecular Formula | C30H40N12O10S2 |
|---|---|
| Molecular Weight | 792.24 g/mol |
| LogP | -0.127 |
| Topological Polar Surface Area | 321.6 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 20 |
| Exact Mass | 792.24316 |
| Heavy Atoms | 54 |
| Complexity | 1998.1891 |
Chemical Identifiers
| CAS Number | 15208-16-9 |
|---|---|
| SMILES | CNC1=NC(=NC(=N1)N(CCO)CCO)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC)N(CCO)CCO)S(=O)(=O)O)S(=O)(=O)O |
Product Overview
RefChem:1078705 (CAS 15208-16-9), with molecular formula C30H40N12O10S2 and molecular weight 792.24 g/mol. IUPAC: 5-[[4-[bis(2-hydroxyethyl)amino]-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-[(E)-2-[4-[[4-[bis(2-hydroxyethyl)amino]-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]ethenyl]benzenesulfonic acid.
Chemical Property Profile of RefChem:1078705
Property Insights of RefChem:1078705
The XLogP value of -0.127 indicates that RefChem:1078705 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 321.6 Ų indicates high polarity, suggesting RefChem:1078705 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1078705 has 10 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1078705?
The CAS number of RefChem:1078705 is 15208-16-9.
What is the molecular formula of RefChem:1078705?
The molecular formula of RefChem:1078705 is C30H40N12O10S2.
What is the molecular weight of RefChem:1078705?
The molecular weight of RefChem:1078705 is 792.24 g/mol.
Where can I buy RefChem:1078705?
You can request a quote for RefChem:1078705 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1078705?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1078705 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.