AB00680470-01
TL;DR: AB00680470-01 (CAS 886928-70-7) is a chemical compound with molecular formula C15H13F2N5O2S2 and molecular weight 397.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C15H13F2N5O2S2 |
|---|---|
| Molecular Weight | 397.05 g/mol |
| LogP | 3.0526 |
| Topological Polar Surface Area | 95.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 397.04788 |
| Heavy Atoms | 26 |
| Complexity | 868.8064 |
Chemical Identifiers
| CAS Number | 886928-70-7 |
|---|---|
| SMILES | C1=CSC(=C1)C2=NN=C(N2N)SCC(=O)NC3=CC=C(C=C3)OC(F)F |
Product Overview
AB00680470-01 (CAS 886928-70-7), with molecular formula C15H13F2N5O2S2 and molecular weight 397.05 g/mol. IUPAC: 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(difluoromethoxy)phenyl]acetamide.
Chemical Property Profile of AB00680470-01
Property Insights of AB00680470-01
The XLogP value of 3.0526 indicates that AB00680470-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.06 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00680470-01. Following Lipinski's Rule of Five, AB00680470-01 has 2 hydrogen bond donor(s) and 7 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 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 397.05 g/mol.
Where can I buy AB00680470-01?
You can request a quote for AB00680470-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00680470-01?
Yes, KEHONG BIO provides custom synthesis services for AB00680470-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.