AB00672061-01
TL;DR: AB00672061-01 (CAS 852375-90-7) is a chemical compound with molecular formula C18H16N6OS2 and molecular weight 396.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
Also Known As: AB00672061-01, F0676-0549, N-(4-methylthiazol-2-yl)-2-((3-(p-tolyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetamide, N-(4-methyl-1,3-thiazol-2-yl)-2-{[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}acetamide, 2-[[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
| Molecular Formula | C18H16N6OS2 |
|---|---|
| Molecular Weight | 396.08 g/mol |
| LogP | 3.59544 |
| Topological Polar Surface Area | 85.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.0827 |
| Heavy Atoms | 27 |
| Complexity | 1102.7029 |
Chemical Identifiers
| CAS Number | 852375-90-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C3N2N=C(C=C3)SCC(=O)NC4=NC(=CS4)C |
Product Overview
AB00672061-01 (CAS 852375-90-7), with molecular formula C18H16N6OS2 and molecular weight 396.08 g/mol. IUPAC: 2-[[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of AB00672061-01
Property Insights of AB00672061-01
The XLogP value of 3.59544 indicates that AB00672061-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.07 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00672061-01. Following Lipinski's Rule of Five, AB00672061-01 has 1 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 AB00672061-01?
The CAS number of AB00672061-01 is 852375-90-7.
What is the molecular formula of AB00672061-01?
The molecular formula of AB00672061-01 is C18H16N6OS2.
What is the molecular weight of AB00672061-01?
The molecular weight of AB00672061-01 is 396.08 g/mol.
Where can I buy AB00672061-01?
You can request a quote for AB00672061-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672061-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672061-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.