2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate
TL;DR: 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate (CAS 102929-09-9) is a chemical compound with molecular formula C13H15NO3S and molecular weight 265.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate
Also Known As: BAS 00702948, 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate, AB00094646-01, 2-methoxyethyl 3-methyl-4H-benzo[b][1,4]thiazine-2-carboxylate, 3-Methyl-4H-benzo[1,4]thiazine-2-carboxylic acid 2-methoxy-ethyl ester
| Molecular Formula | C13H15NO3S |
|---|---|
| Molecular Weight | 265.08 g/mol |
| LogP | 2.6253 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.07727 |
| Heavy Atoms | 18 |
| Complexity | 484.87964 |
Chemical Identifiers
| CAS Number | 102929-09-9 |
|---|---|
| SMILES | CC1=C(SC2=CC=CC=C2N1)C(=O)OCCOC |
Product Overview
2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate (CAS 102929-09-9), with molecular formula C13H15NO3S and molecular weight 265.08 g/mol. IUPAC: 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate.
Chemical Property Profile of 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate
Property Insights of 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate
The XLogP value of 2.6253 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate. With a topological polar surface area (TPSA) of 47.56 Ų, 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate 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
Frequently Asked Questions
What is the CAS number of 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate?
The CAS number of 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate is 102929-09-9.
What is the molecular formula of 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate?
The molecular formula of 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate is C13H15NO3S.
What is the molecular weight of 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate?
The molecular weight of 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate is 265.08 g/mol.
Where can I buy 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate?
You can request a quote for 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-methoxyethyl 3-methyl-4H-1,4-benzothiazine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.