Acetic acid, (2-benzothiazolylamino)oxo-
TL;DR: Acetic acid, (2-benzothiazolylamino)oxo- (CAS 90730-51-1) is a chemical compound with molecular formula C9H6N2O3S and molecular weight 222.00992 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1,3-benzothiazol-2-ylamino)-2-oxoacetic acid
Also Known As: isolupalbigenin, Aceticacid, oxo-, (2-Benzothiazolylamino)oxoacetic acid, N-(Benzothiazol-2-yl)oxamic acid, ACETIC ACID, (2-BENZOTHIAZOLYLAMINO)OXO-
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H6N2O3S |
| Molecular Weight | 222.00992 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.00992 Da |
| Heavy Atoms | 15 |
| Complexity | 285.0 |
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)C(=O)O |
| InChIKey | RXUORKOATDNJFN-UHFFFAOYSA-N |
Chemical Property Profile of Acetic acid, (2-benzothiazolylamino)oxo-
Property Insights of Acetic acid, (2-benzothiazolylamino)oxo-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, (2-benzothiazolylamino)oxo-. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, (2-benzothiazolylamino)oxo-. Following Lipinski's Rule of Five, Acetic acid, (2-benzothiazolylamino)oxo- has 2 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 Acetic acid, (2-benzothiazolylamino)oxo-?
The CAS number of Acetic acid, (2-benzothiazolylamino)oxo- is 90730-51-1.
What is the molecular formula of Acetic acid, (2-benzothiazolylamino)oxo-?
The molecular formula of Acetic acid, (2-benzothiazolylamino)oxo- is C9H6N2O3S.
What is the molecular weight of Acetic acid, (2-benzothiazolylamino)oxo-?
The molecular weight of Acetic acid, (2-benzothiazolylamino)oxo- is 222.00992 g/mol.
Where can I buy Acetic acid, (2-benzothiazolylamino)oxo-?
You can request a quote for Acetic acid, (2-benzothiazolylamino)oxo- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, (2-benzothiazolylamino)oxo-?
Yes, CoreyChem provides custom synthesis services for Acetic acid, (2-benzothiazolylamino)oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.