4,7-Benzoselenazoledione, 5-methoxy-2-methyl-
TL;DR: 4,7-Benzoselenazoledione, 5-methoxy-2-methyl- (CAS 847446-33-7) is a chemical compound with molecular formula C9H7NO3Se and molecular weight 256.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-2-methyl-1,3-benzoselenazole-4,7-dione
Also Known As: 5-methoxy-2-methyl-1,3-benzoselenazole-4,7-dione, 4,7-Benzoselenazoledione, 5-methoxy-2-methyl-, 4,7-Benzoselenazoledione,5-methoxy-2-methyl, RefChem:286016
| Molecular Formula | C9H7NO3Se |
|---|---|
| Molecular Weight | 256.96 g/mol |
| LogP | 0.35632 |
| Topological Polar Surface Area | 56.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 256.9591 |
| Heavy Atoms | 14 |
| Complexity | 458.62216 |
Chemical Identifiers
| CAS Number | 847446-33-7 |
|---|---|
| SMILES | CC1=NC2=C([Se]1)C(=O)C=C(C2=O)OC |
Product Overview
4,7-Benzoselenazoledione, 5-methoxy-2-methyl- (CAS 847446-33-7), with molecular formula C9H7NO3Se and molecular weight 256.96 g/mol. IUPAC: 5-methoxy-2-methyl-1,3-benzoselenazole-4,7-dione.
Chemical Property Profile of 4,7-Benzoselenazoledione, 5-methoxy-2-methyl-
Property Insights of 4,7-Benzoselenazoledione, 5-methoxy-2-methyl-
The XLogP value of 0.35632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,7-Benzoselenazoledione, 5-methoxy-2-methyl-. With a topological polar surface area (TPSA) of 56.26 Ų, 4,7-Benzoselenazoledione, 5-methoxy-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7-Benzoselenazoledione, 5-methoxy-2-methyl- has 0 hydrogen bond donor(s) and 4 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 4,7-Benzoselenazoledione, 5-methoxy-2-methyl-?
The CAS number of 4,7-Benzoselenazoledione, 5-methoxy-2-methyl- is 847446-33-7.
What is the molecular formula of 4,7-Benzoselenazoledione, 5-methoxy-2-methyl-?
The molecular formula of 4,7-Benzoselenazoledione, 5-methoxy-2-methyl- is C9H7NO3Se.
What is the molecular weight of 4,7-Benzoselenazoledione, 5-methoxy-2-methyl-?
The molecular weight of 4,7-Benzoselenazoledione, 5-methoxy-2-methyl- is 256.96 g/mol.
Where can I buy 4,7-Benzoselenazoledione, 5-methoxy-2-methyl-?
You can request a quote for 4,7-Benzoselenazoledione, 5-methoxy-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7-Benzoselenazoledione, 5-methoxy-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 4,7-Benzoselenazoledione, 5-methoxy-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.