AB01277478-01
TL;DR: AB01277478-01 (CAS 894061-45-1) is a chemical compound with molecular formula C21H18N6OS and molecular weight 402.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-pyridin-4-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)sulfanyl]ethanone
Also Known As: AB01277478-01, F2507-0485, 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-pyridin-4-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)sulfanyl]ethanone, 1-(3,4-dihydroquinolin-1(2H)-yl)-2-((6-(pyridin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)thio)ethanone, 1-{[(6-pyridin-4-yl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)thio]acetyl}-1,2,3,4-tetrahydroquinoline
| Molecular Formula | C21H18N6OS |
|---|---|
| Molecular Weight | 402.13 g/mol |
| LogP | 3.2578 |
| Topological Polar Surface Area | 76.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.12628 |
| Heavy Atoms | 29 |
| Complexity | 1176.2437 |
Chemical Identifiers
| CAS Number | 894061-45-1 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C1)C(=O)CSC3=NN=C4N3N=C(C=C4)C5=CC=NC=C5 |
Product Overview
AB01277478-01 (CAS 894061-45-1), with molecular formula C21H18N6OS and molecular weight 402.13 g/mol. IUPAC: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-pyridin-4-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)sulfanyl]ethanone.
Chemical Property Profile of AB01277478-01
Property Insights of AB01277478-01
The XLogP value of 3.2578 indicates that AB01277478-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.28 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01277478-01. Following Lipinski's Rule of Five, AB01277478-01 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 AB01277478-01?
The CAS number of AB01277478-01 is 894061-45-1.
What is the molecular formula of AB01277478-01?
The molecular formula of AB01277478-01 is C21H18N6OS.
What is the molecular weight of AB01277478-01?
The molecular weight of AB01277478-01 is 402.13 g/mol.
Where can I buy AB01277478-01?
You can request a quote for AB01277478-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01277478-01?
Yes, KEHONG BIO provides custom synthesis services for AB01277478-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.