Homoveratrylsydnone
TL;DR: Homoveratrylsydnone (CAS 7356-62-9) is a chemical compound with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(3,4-dimethoxyphenyl)ethyl]oxadiazol-3-ium-5-olate
Also Known As: Homoveratrylsydnone, 3-Homoveratylsydnone, Sydnone, 3-(2-(3,4-dimethoxyphenyl)ethyl)-, Sydnone,4-dimethoxyphenyl)ethyl]-, 3-[2-(3,4-dimethoxyphenyl)ethyl]oxadiazol-3-ium-5-olate
| Molecular Formula | C12H14N2O4 |
|---|---|
| Molecular Weight | 250.10 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.09535 |
| Heavy Atoms | 18 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 7356-62-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC[N+]2=NOC(=C2)[O-])OC |
| InChIKey | JTPXIVVCGJGWEW-UHFFFAOYSA-N |
Product Overview
Homoveratrylsydnone (CAS 7356-62-9), with molecular formula C12H14N2O4 and molecular weight 250.10 g/mol. IUPAC: 3-[2-(3,4-dimethoxyphenyl)ethyl]oxadiazol-3-ium-5-olate.
Chemical Property Profile of Homoveratrylsydnone
Property Insights of Homoveratrylsydnone
The XLogP value of 3.0 indicates that Homoveratrylsydnone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Homoveratrylsydnone. Following Lipinski's Rule of Five, Homoveratrylsydnone has 0 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 Homoveratrylsydnone?
The CAS number of Homoveratrylsydnone is 7356-62-9.
What is the molecular formula of Homoveratrylsydnone?
The molecular formula of Homoveratrylsydnone is C12H14N2O4.
What is the molecular weight of Homoveratrylsydnone?
The molecular weight of Homoveratrylsydnone is 250.10 g/mol.
Where can I buy Homoveratrylsydnone?
You can request a quote for Homoveratrylsydnone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Homoveratrylsydnone?
Yes, KEHONG BIO provides custom synthesis services for Homoveratrylsydnone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.