Funebrine
TL;DR: Funebrine (CAS 90605-98-4) is a chemical compound with molecular formula C18H24N2O5 and molecular weight 348.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,4S,5R)-3-[[1-[(3S,4S,5R)-4,5-dimethyl-2-oxooxolan-3-yl]-5-(hydroxymethyl)pyrrol-2-yl]methylideneamino]-4,5-dimethyloxolan-2-one
Also Known As: Funebrine, (-)-funebrine, J1.125.847F, (3S,4S,5R)-3-[[1-[(3S,4S,5R)-4,5-dimethyl-2-oxooxolan-3-yl]-5-(hydroxymethyl)pyrrol-2-yl]methylideneamino]-4,5-dimethyloxolan-2-one, (3S,4S,5R)-3-((E)-((1-((3S,4S,5R)-4,5-Dimethyl-2-oxotetrahydrofuran-3-yl)-5-(hydroxymethyl)-1H-pyrrol-2-yl)methylene)amino)-4,5-dimethyldihydrofuran-2(3H)-one
| Molecular Formula | C18H24N2O5 |
|---|---|
| Molecular Weight | 348.17 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 90.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.16852 |
| Heavy Atoms | 25 |
| Complexity | 566.0 |
Chemical Identifiers
| CAS Number | 90605-98-4 |
|---|---|
| SMILES | C[C@@H]1[C@H](OC(=O)[C@H]1N=CC2=CC=C(N2[C@H]3[C@@H]([C@H](OC3=O)C)C)CO)C |
| InChIKey | RYQKWJPWKLPCHJ-GRUDOPTHSA-N |
Product Overview
Funebrine (CAS 90605-98-4), with molecular formula C18H24N2O5 and molecular weight 348.17 g/mol. IUPAC: (3S,4S,5R)-3-[[1-[(3S,4S,5R)-4,5-dimethyl-2-oxooxolan-3-yl]-5-(hydroxymethyl)pyrrol-2-yl]methylideneamino]-4,5-dimethyloxolan-2-one.
Chemical Property Profile of Funebrine
Property Insights of Funebrine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Funebrine. The TPSA of 90.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Funebrine. Following Lipinski's Rule of Five, Funebrine has 1 hydrogen bond donor(s) and 6 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 Funebrine?
The CAS number of Funebrine is 90605-98-4.
What is the molecular formula of Funebrine?
The molecular formula of Funebrine is C18H24N2O5.
What is the molecular weight of Funebrine?
The molecular weight of Funebrine is 348.17 g/mol.
Where can I buy Funebrine?
You can request a quote for Funebrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Funebrine?
Yes, KEHONG BIO provides custom synthesis services for Funebrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.