AB00671949-01
TL;DR: AB00671949-01 (CAS 852373-80-9) is a chemical compound with molecular formula C21H18FN5OS and molecular weight 407.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dimethylphenyl)-2-[[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetamide
Also Known As: AB00671949-01, F0676-0258, N-(2,5-dimethylphenyl)-2-((3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetamide, N-(2,5-dimethylphenyl)-2-[[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetamide, N-(2,5-dimethylphenyl)-2-{[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}acetamide
| Molecular Formula | C21H18FN5OS |
|---|---|
| Molecular Weight | 407.12 g/mol |
| LogP | 4.27804 |
| Topological Polar Surface Area | 72.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.1216 |
| Heavy Atoms | 29 |
| Complexity | 1189.6285 |
Chemical Identifiers
| CAS Number | 852373-80-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)NC(=O)CSC2=NN3C(=NN=C3C4=CC=C(C=C4)F)C=C2 |
Product Overview
AB00671949-01 (CAS 852373-80-9), with molecular formula C21H18FN5OS and molecular weight 407.12 g/mol. IUPAC: N-(2,5-dimethylphenyl)-2-[[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetamide.
Chemical Property Profile of AB00671949-01
Property Insights of AB00671949-01
The XLogP value of 4.27804 indicates that AB00671949-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.18 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00671949-01. Following Lipinski's Rule of Five, AB00671949-01 has 1 hydrogen bond donor(s) and 5 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 AB00671949-01?
The CAS number of AB00671949-01 is 852373-80-9.
What is the molecular formula of AB00671949-01?
The molecular formula of AB00671949-01 is C21H18FN5OS.
What is the molecular weight of AB00671949-01?
The molecular weight of AB00671949-01 is 407.12 g/mol.
Where can I buy AB00671949-01?
You can request a quote for AB00671949-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00671949-01?
Yes, KEHONG BIO provides custom synthesis services for AB00671949-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.