RefChem:72388
TL;DR: RefChem:72388 (CAS 71720-91-7) is a chemical compound with molecular formula C24H10ClF2N5Na4O13S4 and molecular weight 868.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetrasodium;7-[[6-[(5-chloro-2,6-difluoropyrimidin-4-yl)amino]-1-hydroxy-3-sulfonatonaphthalen-2-yl]diazenyl]naphthalene-1,3,6-trisulfonate
Also Known As: 1,3,6-Naphthalenetrisulfonic acid, 7-((6-((5-chloro-2,6-difluoro-4-pyrimidinyl)amino)-1-hydroxy-3-sulfo-2-naphthalenyl)azo)-, tetrasodium salt, 1,3,6-Naphthalenetrisulfonic acid, 7-(2-(6-((5-chloro-2,6-difluoro-4-pyrimidinyl)amino)-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)-, sodium salt (1:4), 1,3,6-Naphthalenetrisulfonic acid, 7-[[6-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]-1-hydroxy-3-sulfo-2-naphthalenyl]azo]-, tetrasodium salt, 1,3,6-Naphthalenetrisulfonic acid, 7-[2-[6-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]-1-hydroxy-3-sulfo-2-naphthalenyl]diazenyl]-, sodium salt (1:4), 1,3,6-Naphthalenetrisulfonicacid,7-[2-[6-[(5-chloro-2,6-difluoro-4-pyrimidinyl)amino]-1-hydroxy-3-sulfo-2-naphthalenyl]diazenyl]-,sodium salt (1:4)
| Molecular Formula | C24H10ClF2N5Na4O13S4 |
|---|---|
| Molecular Weight | 868.84 g/mol |
| LogP | -8.7884 |
| Topological Polar Surface Area | 345.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 4 |
| Exact Mass | 868.8405 |
| Heavy Atoms | 53 |
| Complexity | 1640.0 |
Chemical Identifiers
| CAS Number | 71720-91-7 |
|---|---|
| SMILES | C1=CC2=C(C(=C(C=C2C=C1NC3=C(C(=NC(=N3)F)F)Cl)S(=O)(=O)[O-])N=NC4=CC5=C(C=C(C=C5C=C4S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+].[Na+].[Na+] |
| InChIKey | VNDOWZLMZGGEFM-UHFFFAOYSA-J |
Product Overview
RefChem:72388 (CAS 71720-91-7), with molecular formula C24H10ClF2N5Na4O13S4 and molecular weight 868.84 g/mol. IUPAC: tetrasodium;7-[[6-[(5-chloro-2,6-difluoropyrimidin-4-yl)amino]-1-hydroxy-3-sulfonatonaphthalen-2-yl]diazenyl]naphthalene-1,3,6-trisulfonate.
Chemical Property Profile of RefChem:72388
Property Insights of RefChem:72388
The XLogP value of -8.7884 indicates that RefChem:72388 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 345.0 Ų indicates high polarity, suggesting RefChem:72388 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:72388 has 2 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:72388?
The CAS number of RefChem:72388 is 71720-91-7.
What is the molecular formula of RefChem:72388?
The molecular formula of RefChem:72388 is C24H10ClF2N5Na4O13S4.
What is the molecular weight of RefChem:72388?
The molecular weight of RefChem:72388 is 868.84 g/mol.
Where can I buy RefChem:72388?
You can request a quote for RefChem:72388 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:72388?
Yes, KEHONG BIO provides custom synthesis services for RefChem:72388 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.