AB00680470-01
TL;DR: AB00680470-01 (CAS 886928-70-7) is a chemical compound with molecular formula C15H13F2N5O2S2 and molecular weight 397.04788 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide
Also Known As: AB00680470-01, F2649-0301, 2-{[4-amino-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(difluoromethoxy)phenyl]acetamide, 2-((4-amino-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-(difluoromethoxy)phenyl)acetamide, 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide
Technical Specifications
| Molecular Formula | C15H13F2N5O2S2 |
| Molecular Weight | 397.04788 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 149.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 397.04788 Da |
| Heavy Atoms | 26 |
| Complexity | 471.0 |
| SMILES | C1=CSC(=C1)C2=NN=C(N2N)SCC(=O)NC3=CC=C(C=C3)OC(F)F |
| InChIKey | HHXAJCKSBUXERF-UHFFFAOYSA-N |
Chemical Property Profile of AB00680470-01
Property Insights of AB00680470-01
The XLogP value of 3.2 indicates that AB00680470-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.0 Ų indicates high polarity, suggesting AB00680470-01 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AB00680470-01 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of AB00680470-01?
The CAS number of AB00680470-01 is 886928-70-7.
What is the molecular formula of AB00680470-01?
The molecular formula of AB00680470-01 is C15H13F2N5O2S2.
What is the molecular weight of AB00680470-01?
The molecular weight of AB00680470-01 is 397.04788 g/mol.
Where can I buy AB00680470-01?
You can request a quote for AB00680470-01 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AB00680470-01?
Yes, CoreyChem provides custom synthesis services for AB00680470-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.