BAS 00469284
TL;DR: BAS 00469284 (CAS 314293-25-9) is a chemical compound with molecular formula C26H18N6O6S and molecular weight 542.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]diazenyl]benzoic acid
Also Known As: BAS 00469284, 4-[(2Z)-2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]benzoic acid, 4-[[2-[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]diazenyl]benzoic acid, 4-{2-[1-[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}benzoic acid, 4-[({1-[4-(4-methoxyphenyl)(1,3-thiazol-2-yl)]-3-(4-nitrophenyl)-5-oxo-1,2-dia zolin-4-ylidene}azamethyl)amino]benzoic acid
| Molecular Formula | C26H18N6O6S |
|---|---|
| Molecular Weight | 542.10 g/mol |
| LogP | 5.9865 |
| Topological Polar Surface Area | 165.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 542.1008 |
| Heavy Atoms | 39 |
| Complexity | 1752.7245 |
Chemical Identifiers
| CAS Number | 314293-25-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=C(N3)C4=CC=C(C=C4)[N+](=O)[O-])N=NC5=CC=C(C=C5)C(=O)O |
Product Overview
BAS 00469284 (CAS 314293-25-9), with molecular formula C26H18N6O6S and molecular weight 542.10 g/mol. IUPAC: 4-[[2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]diazenyl]benzoic acid.
Chemical Property Profile of BAS 00469284
Property Insights of BAS 00469284
The XLogP value of 5.9865 indicates that BAS 00469284 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 165.07 Ų indicates high polarity, suggesting BAS 00469284 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00469284 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00469284?
The CAS number of BAS 00469284 is 314293-25-9.
What is the molecular formula of BAS 00469284?
The molecular formula of BAS 00469284 is C26H18N6O6S.
What is the molecular weight of BAS 00469284?
The molecular weight of BAS 00469284 is 542.10 g/mol.
Where can I buy BAS 00469284?
You can request a quote for BAS 00469284 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00469284?
Yes, KEHONG BIO provides custom synthesis services for BAS 00469284 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.