Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2)
TL;DR: Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2) (CAS 64282-98-0) is a chemical compound with molecular formula C29H34N4O10S2Zn-4 and molecular weight 726.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[N-[2-(2,5-dioxopyrrolidin-1-yl)ethyl]-3-methyl-4-[(E)-2-(1,3,3-trimethyl-2H-indol-2-yl)ethenyl]anilino]propanenitrile;zinc;disulfate
Also Known As: Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2), 2-(4'-((N-(beta-Cyanoethyl)-N-(beta-succinimidoethyl))amino)-2'-methylstyryl)-1,3,3-trimethylindolinum sulfate zinc sulfate double salt, 2-(4-((N-(Beta-cyanoethyl)-N-(beta-succinimidoethyl))amino)-2-methylstyryl)-1,3,3-trimethylindolinum sulfate zinc sulfate double salt, 3-[N-[2-(2,5-dioxopyrrolidin-1-yl)ethyl]-3-methyl-4-[(E)-2-(1,3,3-trimethyl-2H-indol-2-yl)ethenyl]anilino]propanenitrile; zinc; disulfate, Zinc(4), bis[2-[2-[4-[(2-cyanoethyl)[2-(2,5-dioxo-1-pyrrolidinyl)ethyl]amino]-2-methylphenyl]ethenyl]-1,3,3-trimethyl-3H-indolium]-, sulfate (1:2)
| Molecular Formula | C29H34N4O10S2Zn-4 |
|---|---|
| Molecular Weight | 726.10 g/mol |
| LogP | 1.995 |
| Topological Polar Surface Area | 228.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 726.10077 |
| Heavy Atoms | 46 |
| Complexity | 1612.7253 |
Chemical Identifiers
| CAS Number | 64282-98-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCC#N)CCN2C(=O)CCC2=O)/C=C/C3C(C4=CC=CC=C4N3C)(C)C.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Zn] |
Product Overview
Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2) (CAS 64282-98-0), with molecular formula C29H34N4O10S2Zn-4 and molecular weight 726.10 g/mol. IUPAC: 3-[N-[2-(2,5-dioxopyrrolidin-1-yl)ethyl]-3-methyl-4-[(E)-2-(1,3,3-trimethyl-2H-indol-2-yl)ethenyl]anilino]propanenitrile;zinc;disulfate.
Chemical Property Profile of Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2)
Property Insights of Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2)
The XLogP value of 1.995 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2). The TPSA of 228.17 Ų indicates high polarity, suggesting Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2) has 0 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2)?
The CAS number of Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2) is 64282-98-0.
What is the molecular formula of Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2)?
The molecular formula of Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2) is C29H34N4O10S2Zn-4.
What is the molecular weight of Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2)?
The molecular weight of Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2) is 726.10 g/mol.
Where can I buy Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2)?
You can request a quote for Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2)?
Yes, KEHONG BIO provides custom synthesis services for Zinc(4+), bis(2-(2-(4-((2-cyanoethyl)(2-(2,5-dioxo-1-pyrrolidinyl)ethyl)amino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-3H-indolium)-, sulfate (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.