3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole
TL;DR: 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole (CAS 148193-36-6) is a chemical compound with molecular formula C11H11NO3S and molecular weight 237.04596 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methoxy-7-(oxiran-2-ylmethoxy)-1,2-benzothiazole
Also Known As: 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole, 1,2-Benzisothiazole, 3-methoxy-7-(oxiranylmethoxy)-, 3-Methoxy-7-(2-oxiranylmethoxy)-1,2-benzisothiazole, 3-methoxy-7-(oxiran-2-ylmethoxy)-1,2-benzothiazole, 3-Methoxy-7-[(oxiran-2-yl)methoxy]-1,2-benzothiazole
Technical Specifications
| Molecular Formula | C11H11NO3S |
| Molecular Weight | 237.04596 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.04596 Da |
| Heavy Atoms | 16 |
| Complexity | 253.0 |
| SMILES | COC1=NSC2=C1C=CC=C2OCC3CO3 |
| InChIKey | GCTAJLQPXFIYKC-UHFFFAOYSA-N |
Chemical Property Profile of 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole
Property Insights of 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole. Following Lipinski's Rule of Five, 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole 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
What is the CAS number of 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole?
The CAS number of 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole is 148193-36-6.
What is the molecular formula of 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole?
The molecular formula of 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole is C11H11NO3S.
What is the molecular weight of 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole?
The molecular weight of 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole is 237.04596 g/mol.
Where can I buy 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole?
You can request a quote for 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole?
Yes, CoreyChem provides custom synthesis services for 3-Methoxy-7-(oxiranylmethoxy)-1,2-benzisothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.