Acrophyllidine
TL;DR: Acrophyllidine (CAS 21602-54-0) is a chemical compound with molecular formula C17H19NO4 and molecular weight 301.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(3-hydroxy-3-methylbutyl)-7-methoxyfuro[2,3-b]quinolin-4-one
Also Known As: Acrophyllidine, Acrophyllidin, 9-(3-Hydroxy-3-methylbutyl)-7-methoxyfuro(2,3-b)quinolin-4(9H)-one, 9-(3-Hydroxy-3-methylbutyl)-7-methoxyfuro[2,3-b]quinolin-4(9H)-one, 9-(3-hydroxy-3-methylbutyl)-7-methoxyfuro[2,3-b]quinolin-4-one
| Molecular Formula | C17H19NO4 |
|---|---|
| Molecular Weight | 301.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.1314 |
| Heavy Atoms | 22 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 21602-54-0 |
|---|---|
| SMILES | CC(C)(CCN1C2=C(C=CC(=C2)OC)C(=O)C3=C1OC=C3)O |
| InChIKey | YUPNOSLGVDBAPJ-UHFFFAOYSA-N |
Product Overview
Acrophyllidine (CAS 21602-54-0), with molecular formula C17H19NO4 and molecular weight 301.13 g/mol. IUPAC: 9-(3-hydroxy-3-methylbutyl)-7-methoxyfuro[2,3-b]quinolin-4-one.
Chemical Property Profile of Acrophyllidine
Property Insights of Acrophyllidine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acrophyllidine. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Acrophyllidine. Following Lipinski's Rule of Five, Acrophyllidine 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 Acrophyllidine?
The CAS number of Acrophyllidine is 21602-54-0.
What is the molecular formula of Acrophyllidine?
The molecular formula of Acrophyllidine is C17H19NO4.
What is the molecular weight of Acrophyllidine?
The molecular weight of Acrophyllidine is 301.13 g/mol.
Where can I buy Acrophyllidine?
You can request a quote for Acrophyllidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acrophyllidine?
Yes, KEHONG BIO provides custom synthesis services for Acrophyllidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.