BP Fluor 488 NHS ester, TEA salt
TL;DR: BP Fluor 488 NHS ester, TEA salt (CAS 1025894-97-6) is a chemical compound with molecular formula C25H17N3O13S2 and molecular weight 631.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-amino-6-imino-4,5-disulfoxanthen-9-yl)-5-(2,5-dioxopyrrolidin-1-yl)oxycarbonylbenzoic acid
Also Known As: BP Fluor 488 NHS ester, TEA salt, 2-(6-Amino-3-imino-4,5-disulfo-3H-xanthen-9-yl)-5-(((2,5-dioxopyrrolidin-1-yl)oxy)carbonyl)benzoic acid, 2-(3-amino-6-imino-4,5-disulfoxanthen-9-yl)-5-(2,5-dioxopyrrolidin-1-yl)oxycarbonylbenzoic acid, 2-(6-amino-3-imino-4,5-disulfo-xanthen-9-yl)-5-(2,5-dioxopyrrolidin-1-yl)oxycarbonyl-benzoic Acid
| Molecular Formula | C25H17N3O13S2 |
|---|---|
| Molecular Weight | 631.02 g/mol |
| LogP | 1.67867 |
| Topological Polar Surface Area | 272.73 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 631.02026 |
| Heavy Atoms | 43 |
| Complexity | 2171.8997 |
Chemical Identifiers
| CAS Number | 1025894-97-6 |
|---|---|
| SMILES | C1CC(=O)N(C1=O)OC(=O)C2=CC(=C(C=C2)C3=C4C=CC(=N)C(=C4OC5=C3C=CC(=C5S(=O)(=O)O)N)S(=O)(=O)O)C(=O)O |
Product Overview
BP Fluor 488 NHS ester, TEA salt (CAS 1025894-97-6), with molecular formula C25H17N3O13S2 and molecular weight 631.02 g/mol. IUPAC: 2-(3-amino-6-imino-4,5-disulfoxanthen-9-yl)-5-(2,5-dioxopyrrolidin-1-yl)oxycarbonylbenzoic acid.
Chemical Property Profile of BP Fluor 488 NHS ester, TEA salt
Property Insights of BP Fluor 488 NHS ester, TEA salt
The XLogP value of 1.67867 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BP Fluor 488 NHS ester, TEA salt. The TPSA of 272.73 Ų indicates high polarity, suggesting BP Fluor 488 NHS ester, TEA salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BP Fluor 488 NHS ester, TEA salt has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BP Fluor 488 NHS ester, TEA salt?
The CAS number of BP Fluor 488 NHS ester, TEA salt is 1025894-97-6.
What is the molecular formula of BP Fluor 488 NHS ester, TEA salt?
The molecular formula of BP Fluor 488 NHS ester, TEA salt is C25H17N3O13S2.
What is the molecular weight of BP Fluor 488 NHS ester, TEA salt?
The molecular weight of BP Fluor 488 NHS ester, TEA salt is 631.02 g/mol.
Where can I buy BP Fluor 488 NHS ester, TEA salt?
You can request a quote for BP Fluor 488 NHS ester, TEA salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BP Fluor 488 NHS ester, TEA salt?
Yes, KEHONG BIO provides custom synthesis services for BP Fluor 488 NHS ester, TEA salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.