Pyrroloquinoline quinone-oxazole
TL;DR: Pyrroloquinoline quinone-oxazole (CAS 132847-84-8) is a chemical compound with molecular formula C15H7N3O7 and molecular weight 341.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxa-3,10,16-triazatetracyclo[10.4.0.02,6.07,11]hexadeca-1,3,6,8,10,12,14-heptaene-9,13,15-tricarboxylic acid
Also Known As: Pqq-oxazole, Oxazopyrroloquinoline, Pyrroloquinoline quinone-oxazole, 8H-Oxazolo[5,4-h]pyrrolo[2,3-f]quinoline-5,7,9-tricarboxylicacid, 8H-Oxazolo[5,4-h]pyrrolo[2,3-f]quinoline-5,7,9-tricarboxylic acid
| Molecular Formula | C15H7N3O7 |
|---|---|
| Molecular Weight | 341.03 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.0284 |
| Heavy Atoms | 25 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 132847-84-8 |
|---|---|
| SMILES | C1=C(NC2=C3C(=C4C=C(N=C4C2=C1C(=O)O)C(=O)O)OC=N3)C(=O)O |
| InChIKey | ZRTFQQFHWZPYQM-UHFFFAOYSA-N |
Product Overview
Pyrroloquinoline quinone-oxazole (CAS 132847-84-8), with molecular formula C15H7N3O7 and molecular weight 341.03 g/mol. IUPAC: 5-oxa-3,10,16-triazatetracyclo[10.4.0.02,6.07,11]hexadeca-1,3,6,8,10,12,14-heptaene-9,13,15-tricarboxylic acid.
Chemical Property Profile of Pyrroloquinoline quinone-oxazole
Property Insights of Pyrroloquinoline quinone-oxazole
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrroloquinoline quinone-oxazole. The TPSA of 158.0 Ų indicates high polarity, suggesting Pyrroloquinoline quinone-oxazole may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pyrroloquinoline quinone-oxazole has 4 hydrogen bond donor(s) and 10 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 Pyrroloquinoline quinone-oxazole?
The CAS number of Pyrroloquinoline quinone-oxazole is 132847-84-8.
What is the molecular formula of Pyrroloquinoline quinone-oxazole?
The molecular formula of Pyrroloquinoline quinone-oxazole is C15H7N3O7.
What is the molecular weight of Pyrroloquinoline quinone-oxazole?
The molecular weight of Pyrroloquinoline quinone-oxazole is 341.03 g/mol.
Where can I buy Pyrroloquinoline quinone-oxazole?
You can request a quote for Pyrroloquinoline quinone-oxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrroloquinoline quinone-oxazole?
Yes, KEHONG BIO provides custom synthesis services for Pyrroloquinoline quinone-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.