EINECS 289-028-4
TL;DR: EINECS 289-028-4 (CAS 85959-36-0) is a chemical compound with molecular formula C31H31N3O9S and molecular weight 621.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[[3-[(2,5-dimethoxyphenyl)carbamoyl]-2-hydroxynaphthalen-1-yl]diazenyl]-4-methoxyphenyl]sulfonylethyl propanoate
Also Known As: EINECS 289-028-4, N-(2,5-Dimethoxyphenyl)-3-hydroxy-4-((2-methoxy-5-((2-(1-oxopropoxy)ethyl)sulphonyl)phenyl)azo)naphthalene-2-carboxamide, N- -3-hydroxy-4-[[2-methoxy-5-[[2- ethyl]sulphonyl]phenyl]azo]naphthalene-2-carboxamide, 2-[3-(2-{3-[(2,5-dimethoxyphenyl)carbamoyl]-2-hydroxynaphthalen-1-yl}diazen-1-yl)-4-methoxybenzenesulfonyl]ethyl propanoate, 2-Naphthalenecarboxamide,N-(2,5-dimethoxyphenyl)-3-hydroxy-4-[2-[2-methoxy-5-[[2-(1-oxopropoxy)ethyl]sulfonyl]phenyl]diazenyl]-
| Molecular Formula | C31H31N3O9S |
|---|---|
| Molecular Weight | 621.18 g/mol |
| LogP | 5.9658 |
| Topological Polar Surface Area | 162.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 621.1781 |
| Heavy Atoms | 44 |
| Complexity | 1839.16 |
Chemical Identifiers
| CAS Number | 85959-36-0 |
|---|---|
| SMILES | CCC(=O)OCCS(=O)(=O)C1=CC(=C(C=C1)OC)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=C(C=CC(=C4)OC)OC)O |
Product Overview
EINECS 289-028-4 (CAS 85959-36-0), with molecular formula C31H31N3O9S and molecular weight 621.18 g/mol. IUPAC: 2-[3-[[3-[(2,5-dimethoxyphenyl)carbamoyl]-2-hydroxynaphthalen-1-yl]diazenyl]-4-methoxyphenyl]sulfonylethyl propanoate.
Chemical Property Profile of EINECS 289-028-4
Property Insights of EINECS 289-028-4
The XLogP value of 5.9658 indicates that EINECS 289-028-4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 162.18 Ų indicates high polarity, suggesting EINECS 289-028-4 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 289-028-4 has 2 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 EINECS 289-028-4?
The CAS number of EINECS 289-028-4 is 85959-36-0.
What is the molecular formula of EINECS 289-028-4?
The molecular formula of EINECS 289-028-4 is C31H31N3O9S.
What is the molecular weight of EINECS 289-028-4?
The molecular weight of EINECS 289-028-4 is 621.18 g/mol.
Where can I buy EINECS 289-028-4?
You can request a quote for EINECS 289-028-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 289-028-4?
Yes, KEHONG BIO provides custom synthesis services for EINECS 289-028-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.