Pyrazine, 2-hydroxy-5-methyl-
TL;DR: Pyrazine, 2-hydroxy-5-methyl- (CAS 23598-98-3) is a chemical compound with molecular formula C46H44N6O8S2 and molecular weight 872.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,4-N-bis[4-[(1-methyl-2-pyridinylidene)amino]phenyl]benzene-1,4-dicarboxamide;bis(4-methylbenzenesulfonic acid)
Also Known As: Pyrazine, 2-hydroxy-5-methyl-, SN 6058, n,n'-bis(4-{[(2e)-1-methylpyridin-2(1h)-ylidene]amino}phenyl)benzene-1,4-dicarboxamide 4-methylbenzenesulfonate(1:2), 1-N,4-N-bis[4-[(1-methylpyridin-2-ylidene)amino]phenyl]benzene-1,4-dicarboxamide; 4-methylbenzenesulfonic acid, 1-N,4-N-bis[4-[(1-methylpyridin-2-ylidene)amino]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid
| Molecular Formula | C46H44N6O8S2 |
|---|---|
| Molecular Weight | 872.27 g/mol |
| LogP | 7.81644 |
| Topological Polar Surface Area | 215.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 872.2662 |
| Heavy Atoms | 62 |
| Complexity | 1200.0 |
Chemical Identifiers
| CAS Number | 23598-98-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.CN1C=CC=CC1=NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)N=C5C=CC=CN5C |
| InChIKey | XNHFZBWBSBEDPM-UHFFFAOYSA-N |
Product Overview
Pyrazine, 2-hydroxy-5-methyl- (CAS 23598-98-3), with molecular formula C46H44N6O8S2 and molecular weight 872.27 g/mol. IUPAC: 1-N,4-N-bis[4-[(1-methyl-2-pyridinylidene)amino]phenyl]benzene-1,4-dicarboxamide;bis(4-methylbenzenesulfonic acid).
Chemical Property Profile of Pyrazine, 2-hydroxy-5-methyl-
Property Insights of Pyrazine, 2-hydroxy-5-methyl-
The XLogP value of 7.81644 indicates that Pyrazine, 2-hydroxy-5-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 215.0 Ų indicates high polarity, suggesting Pyrazine, 2-hydroxy-5-methyl- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pyrazine, 2-hydroxy-5-methyl- has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyrazine, 2-hydroxy-5-methyl-?
The CAS number of Pyrazine, 2-hydroxy-5-methyl- is 23598-98-3.
What is the molecular formula of Pyrazine, 2-hydroxy-5-methyl-?
The molecular formula of Pyrazine, 2-hydroxy-5-methyl- is C46H44N6O8S2.
What is the molecular weight of Pyrazine, 2-hydroxy-5-methyl-?
The molecular weight of Pyrazine, 2-hydroxy-5-methyl- is 872.27 g/mol.
Where can I buy Pyrazine, 2-hydroxy-5-methyl-?
You can request a quote for Pyrazine, 2-hydroxy-5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazine, 2-hydroxy-5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Pyrazine, 2-hydroxy-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.