![(2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester structure](/static/products/955/955971-13-8.webp)
(2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester
TL;DR: (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester (CAS 955971-13-8) 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.
methyl 2-(2-oxo-3,4-dihydro-1,4-benzothiazin-3-yl)acetate
Also Known As: BAS 06911073, (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester, methyl (2-oxo-3,4-dihydro-2H-1,4-benzothiazin-3-yl)acetate, methyl 2-(2-oxo-3H,4H-benzo[e]1,4-thiazin-3-yl)acetate, methyl 2-(2-oxo-3,4-dihydro-1,4-benzothiazin-3-yl)acetate
Technical Specifications
| Molecular Formula | C11H11NO3S |
| Molecular Weight | 237.04596 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.04596 Da |
| Heavy Atoms | 16 |
| Complexity | 295.0 |
| SMILES | COC(=O)CC1C(=O)SC2=CC=CC=C2N1 |
| InChIKey | PAEFXQBNXDGIGO-UHFFFAOYSA-N |
Chemical Property Profile of (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester
Property Insights of (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester. Following Lipinski's Rule of Five, (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester has 1 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 (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester?
The CAS number of (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester is 955971-13-8.
What is the molecular formula of (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester?
The molecular formula of (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester is C11H11NO3S.
What is the molecular weight of (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester?
The molecular weight of (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester is 237.04596 g/mol.
Where can I buy (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester?
You can request a quote for (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester?
Yes, CoreyChem provides custom synthesis services for (2-Oxo-3,4-dihydro-2H-benzo[1,4]thiazin-3-yl)-acetic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.