A2470/0104906
TL;DR: A2470/0104906 (CAS 484050-26-2) is a chemical compound with molecular formula C20H14N4O3 and molecular weight 358.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(furan-2-yl)-5-imino-1-methyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Also Known As: A2470/0104906, 3-(2-Furyl)-5-imino-1-methyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile, 3-(furan-2-yl)-5-imino-1-methyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile, (5z)-3-(furan-2-yl)-5-imino-1-methyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile, 3-(2-Furyl)-5-imino-1-methyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile #
| Molecular Formula | C20H14N4O3 |
|---|---|
| Molecular Weight | 358.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.1066 |
| Heavy Atoms | 27 |
| Complexity | 791.0 |
Chemical Identifiers
| CAS Number | 484050-26-2 |
|---|---|
| SMILES | CC12C(C(C(C(O1)C3=CC=CO3)(C(=N)O2)C#N)(C#N)C#N)C4=CC=CC=C4 |
| InChIKey | RHQCNXVWUHSVNE-UHFFFAOYSA-N |
Product Overview
A2470/0104906 (CAS 484050-26-2), with molecular formula C20H14N4O3 and molecular weight 358.11 g/mol. IUPAC: 3-(furan-2-yl)-5-imino-1-methyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile.
Chemical Property Profile of A2470/0104906
Property Insights of A2470/0104906
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2470/0104906. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A2470/0104906. Following Lipinski's Rule of Five, A2470/0104906 has 1 hydrogen bond donor(s) and 7 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 A2470/0104906?
The CAS number of A2470/0104906 is 484050-26-2.
What is the molecular formula of A2470/0104906?
The molecular formula of A2470/0104906 is C20H14N4O3.
What is the molecular weight of A2470/0104906?
The molecular weight of A2470/0104906 is 358.11 g/mol.
Where can I buy A2470/0104906?
You can request a quote for A2470/0104906 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2470/0104906?
Yes, KEHONG BIO provides custom synthesis services for A2470/0104906 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.