EINECS 265-335-9
TL;DR: EINECS 265-335-9 (CAS 65059-52-1) is a chemical compound with molecular formula C25H22N4O8S2 and molecular weight 570.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-methyl-4-[(1Z,3E,5Z)-5-[3-methyl-5-oxo-1-(4-sulfophenyl)pyrazol-4-ylidene]penta-1,3-dienyl]-5-oxo-4H-pyrazol-1-yl]benzenesulfonic acid
Also Known As: EINECS 265-335-9, 4,4'-Pentamethylenebis(1-(p-sulfophenyl)-3-methyl-5-oxopyrazole), Benzenesulfonic acid, 4-(4-(5-(1,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-ylidene)-1,3-pentadien-1-yl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-, Benzenesulfonic acid, 4-(4-(5-(1,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-ylidene)-1,3-pentadienyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-, Benzenesulfonic acid, p-(3-methyl-4-(5-(3-methyl-5-oxo-1-(p-sulfophenyl)-2-pyrazolin-4-ylidene)-1,3-pentadienyl-5-oxo-2-pyrazolin-1-yl)-
| Molecular Formula | C25H22N4O8S2 |
|---|---|
| Molecular Weight | 570.09 g/mol |
| LogP | 2.9802 |
| Topological Polar Surface Area | 174.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 570.0879 |
| Heavy Atoms | 39 |
| Complexity | 1703.74 |
Chemical Identifiers
| CAS Number | 65059-52-1 |
|---|---|
| SMILES | CC1=NN(C(=O)C1/C=C\C=C\C=C/2\C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)O)C)C4=CC=C(C=C4)S(=O)(=O)O |
Product Overview
EINECS 265-335-9 (CAS 65059-52-1), with molecular formula C25H22N4O8S2 and molecular weight 570.09 g/mol. IUPAC: 4-[3-methyl-4-[(1Z,3E,5Z)-5-[3-methyl-5-oxo-1-(4-sulfophenyl)pyrazol-4-ylidene]penta-1,3-dienyl]-5-oxo-4H-pyrazol-1-yl]benzenesulfonic acid.
Chemical Property Profile of EINECS 265-335-9
Property Insights of EINECS 265-335-9
The XLogP value of 2.9802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 265-335-9. The TPSA of 174.08 Ų indicates high polarity, suggesting EINECS 265-335-9 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 265-335-9 has 2 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 265-335-9?
The CAS number of EINECS 265-335-9 is 65059-52-1.
What is the molecular formula of EINECS 265-335-9?
The molecular formula of EINECS 265-335-9 is C25H22N4O8S2.
What is the molecular weight of EINECS 265-335-9?
The molecular weight of EINECS 265-335-9 is 570.09 g/mol.
Where can I buy EINECS 265-335-9?
You can request a quote for EINECS 265-335-9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 265-335-9?
Yes, KEHONG BIO provides custom synthesis services for EINECS 265-335-9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.