AB00670952-01
TL;DR: AB00670952-01 (CAS 862976-52-1) is a chemical compound with molecular formula C16H8F2N4S3 and molecular weight 389.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,6-difluoro-1,3-benzothiazol-2-yl)-7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-amine
Also Known As: AB00670952-01, F0646-8149, N-(4,6-difluorobenzo[d]thiazol-2-yl)-7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-amine, N-(4,6-difluoro-1,3-benzothiazol-2-yl)-11-methyl-3,10-dithia-5,12-diazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2(6),4,7,11-pentaen-4-amine, N-(4,6-difluoro-1,3-benzothiazol-2-yl)-7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-amine
| Molecular Formula | C16H8F2N4S3 |
|---|---|
| Molecular Weight | 389.99 g/mol |
| LogP | 5.84592 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 389.9879 |
| Heavy Atoms | 25 |
| Complexity | 1271.0851 |
Chemical Identifiers
| CAS Number | 862976-52-1 |
|---|---|
| SMILES | CC1=NC2=C(S1)C=CC3=C2SC(=N3)NC4=NC5=C(C=C(C=C5S4)F)F |
Product Overview
AB00670952-01 (CAS 862976-52-1), with molecular formula C16H8F2N4S3 and molecular weight 389.99 g/mol. IUPAC: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-7-methyl-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-amine.
Chemical Property Profile of AB00670952-01
Property Insights of AB00670952-01
The XLogP value of 5.84592 indicates that AB00670952-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.7 Ų, AB00670952-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00670952-01 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00670952-01?
The CAS number of AB00670952-01 is 862976-52-1.
What is the molecular formula of AB00670952-01?
The molecular formula of AB00670952-01 is C16H8F2N4S3.
What is the molecular weight of AB00670952-01?
The molecular weight of AB00670952-01 is 389.99 g/mol.
Where can I buy AB00670952-01?
You can request a quote for AB00670952-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00670952-01?
Yes, KEHONG BIO provides custom synthesis services for AB00670952-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.