Pleniradin acetate
TL;DR: Pleniradin acetate (CAS 25873-32-9) is a chemical compound with molecular formula C17H22O5 and molecular weight 306.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-hydroxy-5,8-dimethyl-1-methylidene-2-oxo-5a,6,7,8a,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-6-yl) acetate
Also Known As: PLENIRADIN ACETATE, (8-hydroxy-5,8-dimethyl-1-methylidene-2-oxo-5a,6,7,8a,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-6-yl) acetate, 5-Hydroxy-5,8-dimethyl-3-methylidene-2-oxo-2,3,3a,4,4a,5,6,7,7a,9a-decahydroazuleno[6,5-b]furan-7-yl acetate, RefChem:373595
| Molecular Formula | C17H22O5 |
|---|---|
| Molecular Weight | 306.15 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.14673 |
| Heavy Atoms | 22 |
| Complexity | 578.0 |
Chemical Identifiers
| CAS Number | 25873-32-9 |
|---|---|
| SMILES | CC1=CC2C(CC3C1C(CC3(C)O)OC(=O)C)C(=C)C(=O)O2 |
| InChIKey | UTPGJEROJZHISI-UHFFFAOYSA-N |
Product Overview
Pleniradin acetate (CAS 25873-32-9), with molecular formula C17H22O5 and molecular weight 306.15 g/mol. IUPAC: (8-hydroxy-5,8-dimethyl-1-methylidene-2-oxo-5a,6,7,8a,9,9a-hexahydro-3aH-azuleno[6,5-b]furan-6-yl) acetate.
Chemical Property Profile of Pleniradin acetate
Property Insights of Pleniradin acetate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pleniradin acetate. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Pleniradin acetate. Following Lipinski's Rule of Five, Pleniradin acetate has 1 hydrogen bond donor(s) and 5 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 Pleniradin acetate?
The CAS number of Pleniradin acetate is 25873-32-9.
What is the molecular formula of Pleniradin acetate?
The molecular formula of Pleniradin acetate is C17H22O5.
What is the molecular weight of Pleniradin acetate?
The molecular weight of Pleniradin acetate is 306.15 g/mol.
Where can I buy Pleniradin acetate?
You can request a quote for Pleniradin acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pleniradin acetate?
Yes, KEHONG BIO provides custom synthesis services for Pleniradin acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.