2,1,3-Benzoselenadiazole, 5-methoxy-
TL;DR: 2,1,3-Benzoselenadiazole, 5-methoxy- (CAS 1126-12-1) is a chemical compound with molecular formula C7H6N2OSe and molecular weight 213.96452 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methoxy-2,1,3-benzoselenadiazole
Also Known As: 5-Methoxypiazselenole, 5-Methoxy-2,1,3-benzoselenadiazole, 2,1,3-Benzoselenadiazole, 5-methoxy-, 5-Methoxybenzo[1,2,5]selenadiazole, 5-Methoxy-2,1,3-benzoselenadiazole #
Technical Specifications
| Molecular Formula | C7H6N2OSe |
| Molecular Weight | 213.96452 g/mol |
| XLogP | 0.6954 |
| Topological Polar Surface Area (TPSA) | 35.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 213.96452 Da |
| Heavy Atoms | 11 |
| Complexity | 144.0 |
| SMILES | COC1=CC2=N[Se]N=C2C=C1 |
| InChIKey | AIUMCRZJPYFOQK-UHFFFAOYSA-N |
Chemical Property Profile of 2,1,3-Benzoselenadiazole, 5-methoxy-
Property Insights of 2,1,3-Benzoselenadiazole, 5-methoxy-
The XLogP value of 0.6954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,1,3-Benzoselenadiazole, 5-methoxy-. With a topological polar surface area (TPSA) of 35.0 Ų, 2,1,3-Benzoselenadiazole, 5-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,1,3-Benzoselenadiazole, 5-methoxy- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,1,3-Benzoselenadiazole, 5-methoxy-?
The CAS number of 2,1,3-Benzoselenadiazole, 5-methoxy- is 1126-12-1.
What is the molecular formula of 2,1,3-Benzoselenadiazole, 5-methoxy-?
The molecular formula of 2,1,3-Benzoselenadiazole, 5-methoxy- is C7H6N2OSe.
What is the molecular weight of 2,1,3-Benzoselenadiazole, 5-methoxy-?
The molecular weight of 2,1,3-Benzoselenadiazole, 5-methoxy- is 213.96452 g/mol.
Where can I buy 2,1,3-Benzoselenadiazole, 5-methoxy-?
You can request a quote for 2,1,3-Benzoselenadiazole, 5-methoxy- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,1,3-Benzoselenadiazole, 5-methoxy-?
Yes, CoreyChem provides custom synthesis services for 2,1,3-Benzoselenadiazole, 5-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.