EINECS 288-541-0
TL;DR: EINECS 288-541-0 (CAS 85750-15-8) is a chemical compound with molecular formula C23H17Cl2N5O6S and molecular weight 561.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-chloro-4-[[1-(3-chlorophenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]-5-hydroxyphenyl]sulfonylamino]benzoic acid
Also Known As: EINECS 288-541-0, 2-(((2-Chloro-4-((1-(3-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-5-hydroxyphenyl)sulphonyl)amino)benzoic acid, 2-(2-chloro-4-{2-[1-(3-chlorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl]diazen-1-yl}-5-hydroxybenzenesulfonamido)benzoic acid, 2-[[(4E)-6-chloro-4-[[1-(3-chlorophenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]hydrazinylidene]-3-oxocyclohexa-1,5-dien-1-yl]sulfonylamino]benzoic acid, 2-[[(4Z)-6-chloro-4-[[1-(3-chlorophenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]hydrazinylidene]-3-oxocyclohexa-1,5-dien-1-yl]sulfonylamino]benzoic acid
| Molecular Formula | C23H17Cl2N5O6S |
|---|---|
| Molecular Weight | 561.03 g/mol |
| LogP | 5.073 |
| Topological Polar Surface Area | 161.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 561.02765 |
| Heavy Atoms | 37 |
| Complexity | 1592.186 |
Chemical Identifiers
| CAS Number | 85750-15-8 |
|---|---|
| SMILES | CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2O)S(=O)(=O)NC3=CC=CC=C3C(=O)O)Cl)C4=CC(=CC=C4)Cl |
Product Overview
EINECS 288-541-0 (CAS 85750-15-8), with molecular formula C23H17Cl2N5O6S and molecular weight 561.03 g/mol. IUPAC: 2-[[2-chloro-4-[[1-(3-chlorophenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]-5-hydroxyphenyl]sulfonylamino]benzoic acid.
Chemical Property Profile of EINECS 288-541-0
Property Insights of EINECS 288-541-0
The XLogP value of 5.073 indicates that EINECS 288-541-0 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 161.09 Ų indicates high polarity, suggesting EINECS 288-541-0 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 288-541-0 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 288-541-0?
The CAS number of EINECS 288-541-0 is 85750-15-8.
What is the molecular formula of EINECS 288-541-0?
The molecular formula of EINECS 288-541-0 is C23H17Cl2N5O6S.
What is the molecular weight of EINECS 288-541-0?
The molecular weight of EINECS 288-541-0 is 561.03 g/mol.
Where can I buy EINECS 288-541-0?
You can request a quote for EINECS 288-541-0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 288-541-0?
Yes, KEHONG BIO provides custom synthesis services for EINECS 288-541-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.