![6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione structure](/static/products/883/88332-13-2.png)
6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
TL;DR: 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione (CAS 88332-13-2) is a chemical compound with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-butylpyrrolo[3,4-b]pyridine-5,7-dione
Also Known As: 6-butylpyrrolo[3,4-b]pyridine-5,7-dione, 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione, J2.923.085D, 6-(n-Butyl)-pyrrolo[3,4-b]pyridine-5,7-dione, 6-butyl-5H,6H,7H-pyrrolo[3,4-b]pyridine-5,7-dione
| Molecular Formula | C11H12N2O2 |
|---|---|
| Molecular Weight | 204.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 50.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.08987 |
| Heavy Atoms | 15 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 88332-13-2 |
|---|---|
| SMILES | CCCCN1C(=O)C2=C(C1=O)N=CC=C2 |
| InChIKey | FOFLFSHQQJSEBO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione (CAS 88332-13-2), with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol. IUPAC: 6-butylpyrrolo[3,4-b]pyridine-5,7-dione.
Chemical Property Profile of 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
Property Insights of 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione. With a topological polar surface area (TPSA) of 50.3 Ų, 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione has 0 hydrogen bond donor(s) and 3 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 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione?
The CAS number of 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione is 88332-13-2.
What is the molecular formula of 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione?
The molecular formula of 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione is C11H12N2O2.
What is the molecular weight of 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione?
The molecular weight of 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione is 204.09 g/mol.
Where can I buy 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione?
You can request a quote for 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-butyl-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.