吡咯并喹啉醌
TL;DR: 吡咯并喹啉醌 (CAS 72909-34-3) is a chemical compound with molecular formula C14H6N2O8 and molecular weight 330.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吡咯并喹啉醌
4,5-dioxo-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid
Also Known As: pyrroloquinoline quinone, methoxatin, Coenzyme pqq, Pqq coenzyme, Pqq cofactor
| Molecular Formula | C14H6N2O8 |
|---|---|
| Molecular Weight | 330.01 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.01242 |
| Heavy Atoms | 24 |
| Complexity | 647.0 |
Chemical Identifiers
| CAS Number | 72909-34-3 |
|---|---|
| SMILES | C1=C(C2=C(C(=O)C(=O)C3=C2NC(=C3)C(=O)O)N=C1C(=O)O)C(=O)O |
| InChIKey | MMXZSJMASHPLLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
吡咯并喹啉醌 (CAS 72909-34-3), with molecular formula C14H6N2O8 and molecular weight 330.01 g/mol. IUPAC: 4,5-dioxo-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid.
Chemical Property Profile of 吡咯并喹啉醌
Property Insights of 吡咯并喹啉醌
The XLogP value of -0.1 indicates that 吡咯并喹啉醌 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 175.0 Ų indicates high polarity, suggesting 吡咯并喹啉醌 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 吡咯并喹啉醌 has 4 hydrogen bond donor(s) and 9 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 吡咯并喹啉醌?
The CAS number of 吡咯并喹啉醌 is 72909-34-3.
What is the molecular formula of 吡咯并喹啉醌?
The molecular formula of 吡咯并喹啉醌 is C14H6N2O8.
What is the molecular weight of 吡咯并喹啉醌?
The molecular weight of 吡咯并喹啉醌 is 330.01 g/mol.
Where can I buy 吡咯并喹啉醌?
You can request a quote for 吡咯并喹啉醌 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吡咯并喹啉醌?
Yes, KEHONG BIO provides custom synthesis services for 吡咯并喹啉醌 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.