谷蓝
TL;DR: 谷蓝 (CAS 2435-59-8) is a chemical compound with molecular formula C10H8N4O4 and molecular weight 248.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
谷蓝
3-(5-amino-2-hydroxy-6-oxo-1H-pyridin-3-yl)-5-iminopyridine-2,6-dione
Also Known As: Indigoidine, Indigoidin, Indigoidine tautomer, 5,5'-Diamino-2H,2'H-[3,3'-bipyridinylidene]-2,2',6,6'(1H,1'H)-tetraone, (5E)-3-amino-5-(5-amino-2,6-dioxopyridin-3-ylidene)pyridine-2,6-dione
| Molecular Formula | C10H8N4O4 |
|---|---|
| Molecular Weight | 248.05 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.05455 |
| Heavy Atoms | 18 |
| Complexity | 597.0 |
Chemical Identifiers
| CAS Number | 2435-59-8 |
|---|---|
| SMILES | C1=C(C(=O)NC(=O)C1=N)C2=C(NC(=O)C(=C2)N)O |
| InChIKey | YCZATMZTIWSFLZ-UHFFFAOYSA-N |
Product Overview
谷蓝 (CAS 2435-59-8), with molecular formula C10H8N4O4 and molecular weight 248.05 g/mol. IUPAC: 3-(5-amino-2-hydroxy-6-oxo-1H-pyridin-3-yl)-5-iminopyridine-2,6-dione.
Chemical Property Profile of 谷蓝
Property Insights of 谷蓝
The XLogP value of -1.9 indicates that 谷蓝 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 145.0 Ų indicates high polarity, suggesting 谷蓝 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 谷蓝 has 5 hydrogen bond donor(s) and 6 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 谷蓝?
The CAS number of 谷蓝 is 2435-59-8.
What is the molecular formula of 谷蓝?
The molecular formula of 谷蓝 is C10H8N4O4.
What is the molecular weight of 谷蓝?
The molecular weight of 谷蓝 is 248.05 g/mol.
Where can I buy 谷蓝?
You can request a quote for 谷蓝 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 谷蓝?
Yes, KEHONG BIO provides custom synthesis services for 谷蓝 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.