KST-1B2967
TL;DR: KST-1B2967 (CAS 31255-22-8) is a chemical compound with molecular formula C10H12N4O6 and molecular weight 284.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5,6-dihydro-2H-pyrazolo[3,4-d]pyridazine-4,7-dione
Also Known As: KST-1B2967, 1,4-anhydro-1-(4,7-dioxo-4,5,6,7-tetrahydro-2h-pyrazolo[3,4-d]pyridazin-3-yl)pentitol, 3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5,6-dihydro-2H-pyrazolo[3,4-d]pyridazine-4,7-dione, 1,4-Anhydro-1-(4-hydroxy-7-oxo-6,7-dihydro-2H-pyrazolo[3,4-d]pyridazin-3-yl)pentitol
| Molecular Formula | C10H12N4O6 |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 157.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.07568 |
| Heavy Atoms | 20 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 31255-22-8 |
|---|---|
| SMILES | C(C1C(C(C(O1)C2=C3C(=NN2)C(=O)NNC3=O)O)O)O |
| InChIKey | MQBRMQYPYVEPNW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
KST-1B2967 (CAS 31255-22-8), with molecular formula C10H12N4O6 and molecular weight 284.08 g/mol. IUPAC: 3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5,6-dihydro-2H-pyrazolo[3,4-d]pyridazine-4,7-dione.
Chemical Property Profile of KST-1B2967
Property Insights of KST-1B2967
The XLogP value of -2.7 indicates that KST-1B2967 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 157.0 Ų indicates high polarity, suggesting KST-1B2967 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, KST-1B2967 has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KST-1B2967?
The CAS number of KST-1B2967 is 31255-22-8.
What is the molecular formula of KST-1B2967?
The molecular formula of KST-1B2967 is C10H12N4O6.
What is the molecular weight of KST-1B2967?
The molecular weight of KST-1B2967 is 284.08 g/mol.
Where can I buy KST-1B2967?
You can request a quote for KST-1B2967 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B2967?
Yes, KEHONG BIO provides custom synthesis services for KST-1B2967 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.