![3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate structure](/static/products/800/80049-21-4.png)
3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate
TL;DR: 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate (CAS 80049-21-4) is a chemical compound with molecular formula C14H14N2O6 and molecular weight 306.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,4-diacetyloxy-3-methyl-3H-pyrrolo[3,4-c]pyridin-6-yl) acetate
Also Known As: 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate, (1,4-diacetyloxy-3-methyl-3H-pyrrolo[3,4-c]pyridin-6-yl) ace, (1,4-diacetyloxy-3-methyl-3H-pyrrolo[3,4-c]pyridin-6-yl) acetate
| Molecular Formula | C14H14N2O6 |
|---|---|
| Molecular Weight | 306.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 306.08517 |
| Heavy Atoms | 22 |
| Complexity | 517.0 |
Chemical Identifiers
| CAS Number | 80049-21-4 |
|---|---|
| SMILES | CC1C2=C(N=C(C=C2C(=N1)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | FRYQNLXJPOMMJS-UHFFFAOYSA-N |
Product Overview
3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate (CAS 80049-21-4), with molecular formula C14H14N2O6 and molecular weight 306.09 g/mol. IUPAC: (1,4-diacetyloxy-3-methyl-3H-pyrrolo[3,4-c]pyridin-6-yl) acetate.
Chemical Property Profile of 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate
Property Insights of 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate. Following Lipinski's Rule of Five, 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate has 0 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 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate?
The CAS number of 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate is 80049-21-4.
What is the molecular formula of 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate?
The molecular formula of 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate is C14H14N2O6.
What is the molecular weight of 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate?
The molecular weight of 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate is 306.09 g/mol.
Where can I buy 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate?
You can request a quote for 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-3H-pyrrolo[3,4-c]pyridine-1,4,6-triyl triacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.