Ro 2-1941
TL;DR: Ro 2-1941 (CAS 66967-97-3) is a chemical compound with molecular formula C24H27N4NaO8S2 and molecular weight 586.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium;benzenesulfonate;4-[[2-(dimethylcarbamoyloxy)-4-(trimethylazaniumyl)phenyl]diazenyl]benzenesulfonate
Also Known As: Ro 2-1941, Ammonium, (3-hydroxy-4-(p-sulfophenylazo)phenyl)trimethyl-, sodium salt, benzenesulfonate, dimethylcarbamate (ester), SODIUM; BENZENESULFONATE;4-[2-(DIMETHYLCARBAMOYLOXY)-4-(TRIMETHYLAZANIUMYL)PHENYL]DIAZENYLBENZENESULFONATE, AMMONIUM, (3-HYDROXY-4-(p-SULFOPHENYLAZO)PHENYL)TRIMETHYL-, SODIUM SALT, BENZENE, Benzenaminium, 3-[[(dimethylamino)carbonyl]oxy]-N,N,N-trimethyl-4-[(4-sulfophenyl)azo]-, benzenesulfonate, sodium salt
| Molecular Formula | C24H27N4NaO8S2 |
|---|---|
| Molecular Weight | 586.12 g/mol |
| LogP | 0.86 |
| Topological Polar Surface Area | 185.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 586.1168 |
| Heavy Atoms | 39 |
| Complexity | 817.0 |
Chemical Identifiers
| CAS Number | 66967-97-3 |
|---|---|
| SMILES | CN(C)C(=O)OC1=C(C=CC(=C1)[N+](C)(C)C)N=NC2=CC=C(C=C2)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+] |
| InChIKey | XDMGSUMGCDAGRA-UHFFFAOYSA-M |
Product Overview
Ro 2-1941 (CAS 66967-97-3), with molecular formula C24H27N4NaO8S2 and molecular weight 586.12 g/mol. IUPAC: sodium;benzenesulfonate;4-[[2-(dimethylcarbamoyloxy)-4-(trimethylazaniumyl)phenyl]diazenyl]benzenesulfonate.
Chemical Property Profile of Ro 2-1941
Property Insights of Ro 2-1941
The XLogP value of 0.86 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ro 2-1941. The TPSA of 185.0 Ų indicates high polarity, suggesting Ro 2-1941 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ro 2-1941 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ro 2-1941?
The CAS number of Ro 2-1941 is 66967-97-3.
What is the molecular formula of Ro 2-1941?
The molecular formula of Ro 2-1941 is C24H27N4NaO8S2.
What is the molecular weight of Ro 2-1941?
The molecular weight of Ro 2-1941 is 586.12 g/mol.
Where can I buy Ro 2-1941?
You can request a quote for Ro 2-1941 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ro 2-1941?
Yes, KEHONG BIO provides custom synthesis services for Ro 2-1941 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.