RefChem:465277
TL;DR: RefChem:465277 (CAS 67875-10-9) is a chemical compound with molecular formula C22H14ClN3Na2O9S2 and molecular weight 608.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;1-amino-4-[4-[(2-chloroacetyl)amino]-3-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate
Also Known As: 2-Anthracenesulfonic acid, 1-amino-4-[[4-[(chloroacetyl)amino]-3-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-, disodium salt, 2-Anthracenesulfonic acid, 1-amino-4-((4-((2-chloroacetyl)amino)-3-sulfophenyl)amino)-9,10-dihydro-9,10-dioxo-, sodium salt (1:2), 2-Anthracenesulfonic acid, 1-amino-4-((4-((chloroacetyl)amino)-3-sulfophenyl)amino)-9,10-dihydro-9,10-dioxo-, disodium salt, 2-Anthraquinonesulfonic acid, 1-amino-4-((4-(chloroacetylamino)-3-sulfophenyl)amino)-, disodium salt, disodium 1-amino-4-({4-[(chloroacetyl)amino]-3-sulfonatophenyl}amino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate
| Molecular Formula | C22H14ClN3Na2O9S2 |
|---|---|
| Molecular Weight | 608.97 g/mol |
| LogP | -4.22 |
| Topological Polar Surface Area | 232.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 608.9655 |
| Heavy Atoms | 39 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 67875-10-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)NC(=O)CCl)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+] |
| InChIKey | JNWAORGDZSHRHU-UHFFFAOYSA-L |
Product Overview
RefChem:465277 (CAS 67875-10-9), with molecular formula C22H14ClN3Na2O9S2 and molecular weight 608.97 g/mol. IUPAC: disodium;1-amino-4-[4-[(2-chloroacetyl)amino]-3-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate.
Chemical Property Profile of RefChem:465277
Property Insights of RefChem:465277
The XLogP value of -4.22 indicates that RefChem:465277 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 232.0 Ų indicates high polarity, suggesting RefChem:465277 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:465277 has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:465277?
The CAS number of RefChem:465277 is 67875-10-9.
What is the molecular formula of RefChem:465277?
The molecular formula of RefChem:465277 is C22H14ClN3Na2O9S2.
What is the molecular weight of RefChem:465277?
The molecular weight of RefChem:465277 is 608.97 g/mol.
Where can I buy RefChem:465277?
You can request a quote for RefChem:465277 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:465277?
Yes, KEHONG BIO provides custom synthesis services for RefChem:465277 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.