EINECS 285-790-7
TL;DR: EINECS 285-790-7 (CAS 85136-65-8) is a chemical compound with molecular formula C22H16Cl2N4O5S and molecular weight 518.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[[5-chloro-2-(2-chlorophenoxy)phenyl]diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonic acid
Also Known As: EINECS 285-790-7, 4-(4-((5-Chloro-2-(2-chlorophenoxy)phenyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid, 4-[4-[[5-CHLORO-2-(2-CHLOROPHENOXY)PHENYL]AZO]-4,5-DIHYDRO-3-METHYL-5-OXO-1H-PYRAZOL-1-YL]BENZENESULFONIC ACID, 4-[4-[[5-chloro-2-(2-chlorophenoxy)phenyl]diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonic acid, 4-(4-{2-[5-chloro-2-(2-chlorophenoxy)phenyl]diazen-1-yl}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzene-1-sulfonic acid
| Molecular Formula | C22H16Cl2N4O5S |
|---|---|
| Molecular Weight | 518.02 g/mol |
| LogP | 5.9074 |
| Topological Polar Surface Area | 120.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 518.02185 |
| Heavy Atoms | 34 |
| Complexity | 1425.4624 |
Chemical Identifiers
| CAS Number | 85136-65-8 |
|---|---|
| SMILES | CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3Cl)C4=CC=C(C=C4)S(=O)(=O)O |
Product Overview
EINECS 285-790-7 (CAS 85136-65-8), with molecular formula C22H16Cl2N4O5S and molecular weight 518.02 g/mol. IUPAC: 4-[4-[[5-chloro-2-(2-chlorophenoxy)phenyl]diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonic acid.
Chemical Property Profile of EINECS 285-790-7
Property Insights of EINECS 285-790-7
The XLogP value of 5.9074 indicates that EINECS 285-790-7 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.99 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 285-790-7. Following Lipinski's Rule of Five, EINECS 285-790-7 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 285-790-7?
The CAS number of EINECS 285-790-7 is 85136-65-8.
What is the molecular formula of EINECS 285-790-7?
The molecular formula of EINECS 285-790-7 is C22H16Cl2N4O5S.
What is the molecular weight of EINECS 285-790-7?
The molecular weight of EINECS 285-790-7 is 518.02 g/mol.
Where can I buy EINECS 285-790-7?
You can request a quote for EINECS 285-790-7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 285-790-7?
Yes, KEHONG BIO provides custom synthesis services for EINECS 285-790-7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.