4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one
TL;DR: 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one (CAS 212692-15-4) is a chemical compound with molecular formula C11H8N4O4 and molecular weight 260.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,9-dihydroxy-13-oxa-10,12,14,16-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,11,14-pentaen-8-one
Also Known As: 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one, 4a,9b-dihydroxy-4,10,4a,9b-tetrahydroindano[2,1-b]1,2,5-oxadiazolo[3,4-e]pyraz in-5-one
| Molecular Formula | C11H8N4O4 |
|---|---|
| Molecular Weight | 260.05 g/mol |
| LogP | -0.3628 |
| Topological Polar Surface Area | 120.51 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 260.05457 |
| Heavy Atoms | 19 |
| Complexity | 714.2257 |
Chemical Identifiers
| CAS Number | 212692-15-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3(C2(NC4=NON=C4N3)O)O |
Product Overview
4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one (CAS 212692-15-4), with molecular formula C11H8N4O4 and molecular weight 260.05 g/mol. IUPAC: 1,9-dihydroxy-13-oxa-10,12,14,16-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,11,14-pentaen-8-one.
Chemical Property Profile of 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one
Property Insights of 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one
The XLogP value of -0.3628 indicates that 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one. Following Lipinski's Rule of Five, 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one has 4 hydrogen bond donor(s) and 8 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 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one?
The CAS number of 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one is 212692-15-4.
What is the molecular formula of 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one?
The molecular formula of 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one is C11H8N4O4.
What is the molecular weight of 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one?
The molecular weight of 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one is 260.05 g/mol.
Where can I buy 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one?
You can request a quote for 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one?
Yes, KEHONG BIO provides custom synthesis services for 4a,9a-dihydroxy-9a,10-dihydro-4H-indeno[1,2-b][1,2,5]oxadiazolo[3,4-e]pyrazin-9(4aH)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.