1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one
TL;DR: 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one (CAS 39243-88-4) is a chemical compound with molecular formula C11H9N3O3 and molecular weight 231.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-hydroxy-7-methylpyrrolo[2,3-g][2,1,3]benzoxadiazol-8-yl)ethanone
Also Known As: Maybridge1_006869, 8-Acetyl-7-methyl-6H-1,2,5-oxadiazolo[3,4-e]indol-6-ol, KST-1B3875, 1-(6-hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethanone, SDCCGMLS-0066209.P001
| Molecular Formula | C11H9N3O3 |
|---|---|
| Molecular Weight | 231.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 81.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.06439 |
| Heavy Atoms | 17 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 39243-88-4 |
|---|---|
| SMILES | CC1=C(C2=C(N1O)C=CC3=NON=C32)C(=O)C |
| InChIKey | YEOVCYIWTIZJMV-UHFFFAOYSA-N |
Product Overview
1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one (CAS 39243-88-4), with molecular formula C11H9N3O3 and molecular weight 231.06 g/mol. IUPAC: 1-(6-hydroxy-7-methylpyrrolo[2,3-g][2,1,3]benzoxadiazol-8-yl)ethanone.
Chemical Property Profile of 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one
Property Insights of 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one. The TPSA of 81.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one. Following Lipinski's Rule of Five, 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one has 1 hydrogen bond donor(s) and 5 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 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one?
The CAS number of 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one is 39243-88-4.
What is the molecular formula of 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one?
The molecular formula of 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one is C11H9N3O3.
What is the molecular weight of 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one?
The molecular weight of 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one is 231.06 g/mol.
Where can I buy 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one?
You can request a quote for 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(6-Hydroxy-7-methyl-6h-[1,2,5]oxadiazolo[3,4-e]indol-8-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.