Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester
TL;DR: Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester (CAS 104388-83-2) is a chemical compound with molecular formula C11H11N3O5S2 and molecular weight 329.014 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-oxo-2-[(6-sulfamoyl-1,3-benzothiazol-2-yl)amino]acetate
Also Known As: Benzothiazolyl-2-oxaminic acid, 6-(aminosulfonyl)-, ethyl ester, ACETIC ACID, ((6-(AMINOSULFONYL)-2-BENZOTHIAZOLYL)AMINO)OXO-, ETHYL ESTER, ((6-(Aminosulfonyl)-2-benzothiazolyl)amino)oxoacetic acid ethyl ester, ethyl oxo[(6-sulfamoyl-1,3-benzothiazol-2-yl)amino]acetate, ethyl 2-oxo-2-[(6-sulfamoyl-1,3-benzothiazol-2-yl)amino]acetate
Technical Specifications
| Molecular Formula | C11H11N3O5S2 |
| Molecular Weight | 329.014 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 165.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.014 Da |
| Heavy Atoms | 21 |
| Complexity | 518.0 |
| SMILES | CCOC(=O)C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N |
| InChIKey | AWTCTAGPFRAGIS-UHFFFAOYSA-N |
Chemical Property Profile of Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester
Property Insights of Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester. The TPSA of 165.0 Ų indicates high polarity, suggesting Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester?
The CAS number of Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester is 104388-83-2.
What is the molecular formula of Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester?
The molecular formula of Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester is C11H11N3O5S2.
What is the molecular weight of Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester?
The molecular weight of Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester is 329.014 g/mol.
Where can I buy Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester?
You can request a quote for Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for Acetic acid, ((6-(aminosulfonyl)-2-benzothiazolyl)amino)oxo-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.