AB00411856-04
TL;DR: AB00411856-04 (CAS 852375-93-0) is a chemical compound with molecular formula C18H16N6O2S and molecular weight 380.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-methyl-1,2-oxazol-3-yl)-2-[[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetamide
Also Known As: AB00411856-04, F0676-0553, N-(5-methyl-1,2-oxazol-3-yl)-2-{[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}acetamide, N-(5-methyl-1,2-oxazol-3-yl)-2-[[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetamide, N-(5-methylisoxazol-3-yl)-2-{[3-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio}acetamide
| Molecular Formula | C18H16N6O2S |
|---|---|
| Molecular Weight | 380.11 g/mol |
| LogP | 3.12694 |
| Topological Polar Surface Area | 98.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.10553 |
| Heavy Atoms | 27 |
| Complexity | 1102.7029 |
Chemical Identifiers
| CAS Number | 852375-93-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C3N2N=C(C=C3)SCC(=O)NC4=NOC(=C4)C |
Product Overview
AB00411856-04 (CAS 852375-93-0), with molecular formula C18H16N6O2S and molecular weight 380.11 g/mol. IUPAC: N-(5-methyl-1,2-oxazol-3-yl)-2-[[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetamide.
Chemical Property Profile of AB00411856-04
Property Insights of AB00411856-04
The XLogP value of 3.12694 indicates that AB00411856-04 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.21 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00411856-04. Following Lipinski's Rule of Five, AB00411856-04 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 AB00411856-04?
The CAS number of AB00411856-04 is 852375-93-0.
What is the molecular formula of AB00411856-04?
The molecular formula of AB00411856-04 is C18H16N6O2S.
What is the molecular weight of AB00411856-04?
The molecular weight of AB00411856-04 is 380.11 g/mol.
Where can I buy AB00411856-04?
You can request a quote for AB00411856-04 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00411856-04?
Yes, KEHONG BIO provides custom synthesis services for AB00411856-04 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.