AB00711069-01
TL;DR: AB00711069-01 (CAS 378227-70-4) is a chemical compound with molecular formula C17H11F2N3O2S2 and molecular weight 391.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(difluoromethoxy)phenyl]-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone
Also Known As: AB00711069-01, AF-399/15539260, 1-[4-(difluoromethoxy)phenyl]-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)ethanone, 1-[4-(difluoromethoxy)phenyl]-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone
| Molecular Formula | C17H11F2N3O2S2 |
|---|---|
| Molecular Weight | 391.03 g/mol |
| LogP | 4.5204 |
| Topological Polar Surface Area | 56.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.02606 |
| Heavy Atoms | 26 |
| Complexity | 1076.6993 |
Chemical Identifiers
| CAS Number | 378227-70-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N3C(=NN=C3SCC(=O)C4=CC=C(C=C4)OC(F)F)S2 |
Product Overview
AB00711069-01 (CAS 378227-70-4), with molecular formula C17H11F2N3O2S2 and molecular weight 391.03 g/mol. IUPAC: 1-[4-(difluoromethoxy)phenyl]-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone.
Chemical Property Profile of AB00711069-01
Property Insights of AB00711069-01
The XLogP value of 4.5204 indicates that AB00711069-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.49 Ų, AB00711069-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00711069-01 has 0 hydrogen bond donor(s) and 6 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 AB00711069-01?
The CAS number of AB00711069-01 is 378227-70-4.
What is the molecular formula of AB00711069-01?
The molecular formula of AB00711069-01 is C17H11F2N3O2S2.
What is the molecular weight of AB00711069-01?
The molecular weight of AB00711069-01 is 391.03 g/mol.
Where can I buy AB00711069-01?
You can request a quote for AB00711069-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00711069-01?
Yes, KEHONG BIO provides custom synthesis services for AB00711069-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.