依布硒
TL;DR: 依布硒 (CAS 60940-34-3) is a chemical compound with molecular formula C13H9NOSe and molecular weight 274.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
依布硒
2-phenyl-1,2-benzoselenazol-3-one
Also Known As: ebselen, Ebselenum, Ebselene, Ebseleno, Harmokisane
| Molecular Formula | C13H9NOSe |
|---|---|
| Molecular Weight | 274.98 g/mol |
| LogP | 2.05 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.98495 |
| Heavy Atoms | 16 |
| Complexity | 275.0 |
| Solubility | 6.6 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 60940-34-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3[Se]2 |
| InChIKey | DYEFUKCXAQOFHX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
依布硒 (CAS 60940-34-3), with molecular formula C13H9NOSe and molecular weight 274.98 g/mol. IUPAC: 2-phenyl-1,2-benzoselenazol-3-one.
Chemical Property Profile of 依布硒
Property Insights of 依布硒
The XLogP value of 2.05 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 依布硒. With a topological polar surface area (TPSA) of 20.3 Ų, 依布硒 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 依布硒 has 0 hydrogen bond donor(s) and 1 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 依布硒?
The CAS number of 依布硒 is 60940-34-3.
What is the molecular formula of 依布硒?
The molecular formula of 依布硒 is C13H9NOSe.
What is the molecular weight of 依布硒?
The molecular weight of 依布硒 is 274.98 g/mol.
Where can I buy 依布硒?
You can request a quote for 依布硒 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 依布硒?
Yes, KEHONG BIO provides custom synthesis services for 依布硒 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.