EINECS 299-652-9
TL;DR: EINECS 299-652-9 (CAS 93893-62-0) is a chemical compound with molecular formula C20H16N4O5S and molecular weight 424.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-5-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]naphthalene-1-sulfonic acid
Also Known As: EINECS 299-652-9, 5-((4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-6-hydroxynaphthalene-1-sulphonic acid, 5-[(4,5-DIHYDRO-3-METHYL-5-OXO-1-PHENYL-1H-PYRAZOL-4-YL)AZO]-6-HYDROXYNAPHTHALENE-1-SULFONIC ACID, (5E)-5-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)hydrazinylidene]-6-oxonaphthalene-1-sulfonic acid, 5-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-6-hydroxynaphthalene-1-sulphonic acid
| Molecular Formula | C20H16N4O5S |
|---|---|
| Molecular Weight | 424.08 g/mol |
| LogP | 3.6671 |
| Topological Polar Surface Area | 131.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.08414 |
| Heavy Atoms | 30 |
| Complexity | 1319.7811 |
Chemical Identifiers
| CAS Number | 93893-62-0 |
|---|---|
| SMILES | CC1=NN(C(=O)C1N=NC2=C(C=CC3=C2C=CC=C3S(=O)(=O)O)O)C4=CC=CC=C4 |
Product Overview
EINECS 299-652-9 (CAS 93893-62-0), with molecular formula C20H16N4O5S and molecular weight 424.08 g/mol. IUPAC: 6-hydroxy-5-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]naphthalene-1-sulfonic acid.
Chemical Property Profile of EINECS 299-652-9
Property Insights of EINECS 299-652-9
The XLogP value of 3.6671 indicates that EINECS 299-652-9 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.99 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 299-652-9. Following Lipinski's Rule of Five, EINECS 299-652-9 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 299-652-9?
The CAS number of EINECS 299-652-9 is 93893-62-0.
What is the molecular formula of EINECS 299-652-9?
The molecular formula of EINECS 299-652-9 is C20H16N4O5S.
What is the molecular weight of EINECS 299-652-9?
The molecular weight of EINECS 299-652-9 is 424.08 g/mol.
Where can I buy EINECS 299-652-9?
You can request a quote for EINECS 299-652-9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 299-652-9?
Yes, KEHONG BIO provides custom synthesis services for EINECS 299-652-9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.