TACA
TL;DR: TACA (CAS 105186-34-3) is a chemical compound with molecular formula C10H11N5O3S2 and molecular weight 313.03033 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6R,7R)-7-amino-8-oxo-3-(2H-triazol-4-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: TACA, 7-ACA triazole, 7-TACA, Cefoperazone EP Impurity D, Cefoperazone Impurity D
Technical Specifications
| Molecular Formula | C10H11N5O3S2 |
| Molecular Weight | 313.03033 g/mol |
| XLogP | -3.5 |
| Topological Polar Surface Area (TPSA) | 176.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.03033 Da |
| Heavy Atoms | 20 |
| Complexity | 486.0 |
| SMILES | C1C(=C(N2[C@H](S1)[C@@H](C2=O)N)C(=O)O)CSC3=NNN=C3 |
| InChIKey | MLOZJRLUNNFSGD-HZGVNTEJSA-N |
Chemical Property Profile of TACA
Property Insights of TACA
The XLogP value of -3.5 indicates that TACA is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 176.0 Ų indicates high polarity, suggesting TACA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, TACA has 3 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 TACA?
The CAS number of TACA is 105186-34-3.
What is the molecular formula of TACA?
The molecular formula of TACA is C10H11N5O3S2.
What is the molecular weight of TACA?
The molecular weight of TACA is 313.03033 g/mol.
Where can I buy TACA?
You can request a quote for TACA directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for TACA?
Yes, CoreyChem provides custom synthesis services for TACA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.