RefChem:530076
TL;DR: RefChem:530076 (CAS 478250-33-8) is a chemical compound with molecular formula C40H55N5O5S and molecular weight 717.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-[[2-(dimethylamino)phenyl]diazenyl]-3-heptadecyl-5-oxo-4H-pyrazol-1-yl]-2-phenoxybenzenesulfonic acid
Also Known As: Salor-int l210994-1ea, 5-(4-{(E)-[2-(dimethylamino)phenyl]diazenyl}-3-heptadecyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)-2-phenoxybenzenesulfonic acid, 5-(4-((E)-(2-(DIMETHYLAMINO)PHENYL)DIAZENYL)-3-HEPTADECYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-1-YL)-2-PHENOXYBENZENESULFONIC ACID, 5-(4-{[2-(dimethylamino)phenyl]diazenyl}-3-heptadecyl-5-oxo(2-pyrazolinyl))-2- phenoxybenzenesulfonic acid, 5-[4-[[2-(dimethylamino)phenyl]diazenyl]-3-heptadecyl-5-oxo-4H-pyrazol-1-yl]-2-phenoxybenzenesulfonic acid
| Molecular Formula | C40H55N5O5S |
|---|---|
| Molecular Weight | 717.39 g/mol |
| LogP | 10.9082 |
| Topological Polar Surface Area | 124.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 23 |
| Exact Mass | 717.3924 |
| Heavy Atoms | 51 |
| Complexity | 1694.2385 |
Chemical Identifiers
| CAS Number | 478250-33-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC1=NN(C(=O)C1N=NC2=CC=CC=C2N(C)C)C3=CC(=C(C=C3)OC4=CC=CC=C4)S(=O)(=O)O |
Product Overview
RefChem:530076 (CAS 478250-33-8), with molecular formula C40H55N5O5S and molecular weight 717.39 g/mol. IUPAC: 5-[4-[[2-(dimethylamino)phenyl]diazenyl]-3-heptadecyl-5-oxo-4H-pyrazol-1-yl]-2-phenoxybenzenesulfonic acid.
Chemical Property Profile of RefChem:530076
Property Insights of RefChem:530076
The XLogP value of 10.9082 indicates that RefChem:530076 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.23 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:530076. Following Lipinski's Rule of Five, RefChem:530076 has 1 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 RefChem:530076?
The CAS number of RefChem:530076 is 478250-33-8.
What is the molecular formula of RefChem:530076?
The molecular formula of RefChem:530076 is C40H55N5O5S.
What is the molecular weight of RefChem:530076?
The molecular weight of RefChem:530076 is 717.39 g/mol.
Where can I buy RefChem:530076?
You can request a quote for RefChem:530076 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:530076?
Yes, KEHONG BIO provides custom synthesis services for RefChem:530076 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.