bicyclo-PGEM
TL;DR: bicyclo-PGEM (CAS 109826-53-1) is a chemical compound with molecular formula C20H30O4 and molecular weight 334.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-butyl-2,5-dioxo-3,3a,4,6,7,7a-hexahydro-1H-inden-1-yl)hept-5-enoic acid
Also Known As: bicyclo-PGEM;, BICYCLO PROSTAGLANDIN E2, TRK 800
| Molecular Formula | C20H30O4 |
|---|---|
| Molecular Weight | 334.21 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 334.21442 |
| Heavy Atoms | 24 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 109826-53-1 |
|---|---|
| SMILES | CCCCC1C2CC(=O)C(C2CCC1=O)CC=CCCCC(=O)O |
| InChIKey | CGCZPIJMGKLVTQ-UHFFFAOYSA-N |
Product Overview
bicyclo-PGEM (CAS 109826-53-1), with molecular formula C20H30O4 and molecular weight 334.21 g/mol. IUPAC: 7-(4-butyl-2,5-dioxo-3,3a,4,6,7,7a-hexahydro-1H-inden-1-yl)hept-5-enoic acid.
Chemical Property Profile of bicyclo-PGEM
Property Insights of bicyclo-PGEM
The XLogP value of 3.1 indicates that bicyclo-PGEM is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for bicyclo-PGEM. Following Lipinski's Rule of Five, bicyclo-PGEM has 1 hydrogen bond donor(s) and 4 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 bicyclo-PGEM?
The CAS number of bicyclo-PGEM is 109826-53-1.
What is the molecular formula of bicyclo-PGEM?
The molecular formula of bicyclo-PGEM is C20H30O4.
What is the molecular weight of bicyclo-PGEM?
The molecular weight of bicyclo-PGEM is 334.21 g/mol.
Where can I buy bicyclo-PGEM?
You can request a quote for bicyclo-PGEM directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for bicyclo-PGEM?
Yes, KEHONG BIO provides custom synthesis services for bicyclo-PGEM and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.