Putaminoxin
TL;DR: Putaminoxin (CAS 172104-03-9) is a chemical compound with molecular formula C12H20O3 and molecular weight 212.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E,6S)-6-hydroxy-2-propyl-2,3,6,7,8,9-hexahydrooxecin-10-one
Also Known As: Putaminoxin, (4E,6S)-6-hydroxy-2-propyl-2,3,6,7,8,9-hexahydrooxecin-10-one, (6S,7E)-6-Hydroxy-10-propyl-3,4,5,6,9,10-hexahydro-2H-oxecin-2-one, RefChem:177338
| Molecular Formula | C12H20O3 |
|---|---|
| Molecular Weight | 212.14 g/mol |
| LogP | 2.1894 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.14125 |
| Heavy Atoms | 15 |
| Complexity | 222.90712 |
Chemical Identifiers
| CAS Number | 172104-03-9 |
|---|---|
| SMILES | CCCC1C/C=C/[C@H](CCCC(=O)O1)O |
Product Overview
Putaminoxin (CAS 172104-03-9), with molecular formula C12H20O3 and molecular weight 212.14 g/mol. IUPAC: (4E,6S)-6-hydroxy-2-propyl-2,3,6,7,8,9-hexahydrooxecin-10-one.
Chemical Property Profile of Putaminoxin
Property Insights of Putaminoxin
The XLogP value of 2.1894 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Putaminoxin. With a topological polar surface area (TPSA) of 46.53 Ų, Putaminoxin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Putaminoxin has 1 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 Putaminoxin?
The CAS number of Putaminoxin is 172104-03-9.
What is the molecular formula of Putaminoxin?
The molecular formula of Putaminoxin is C12H20O3.
What is the molecular weight of Putaminoxin?
The molecular weight of Putaminoxin is 212.14 g/mol.
Where can I buy Putaminoxin?
You can request a quote for Putaminoxin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Putaminoxin?
Yes, KEHONG BIO provides custom synthesis services for Putaminoxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.