AB00412065-04
TL;DR: AB00412065-04 (CAS 852372-81-7) is a chemical compound with molecular formula C17H14N6O2S and molecular weight 366.09 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-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide
Also Known As: AB00412065-04, F0676-0077, N-(5-methylisoxazol-3-yl)-2-((3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetamide, N-(5-methylisoxazol-3-yl)-2-[(3-phenyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio]acetamide, N-(5-methyl-1,2-oxazol-3-yl)-2-({3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl}sulfanyl)acetamide
| Molecular Formula | C17H14N6O2S |
|---|---|
| Molecular Weight | 366.09 g/mol |
| LogP | 2.81852 |
| Topological Polar Surface Area | 98.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.0899 |
| Heavy Atoms | 26 |
| Complexity | 1059.5084 |
Chemical Identifiers
| CAS Number | 852372-81-7 |
|---|---|
| SMILES | CC1=CC(=NO1)NC(=O)CSC2=NN3C(=NN=C3C4=CC=CC=C4)C=C2 |
Product Overview
AB00412065-04 (CAS 852372-81-7), with molecular formula C17H14N6O2S and molecular weight 366.09 g/mol. IUPAC: N-(5-methyl-1,2-oxazol-3-yl)-2-[(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00412065-04
Property Insights of AB00412065-04
The XLogP value of 2.81852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00412065-04. The TPSA of 98.21 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00412065-04. Following Lipinski's Rule of Five, AB00412065-04 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 AB00412065-04?
The CAS number of AB00412065-04 is 852372-81-7.
What is the molecular formula of AB00412065-04?
The molecular formula of AB00412065-04 is C17H14N6O2S.
What is the molecular weight of AB00412065-04?
The molecular weight of AB00412065-04 is 366.09 g/mol.
Where can I buy AB00412065-04?
You can request a quote for AB00412065-04 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00412065-04?
Yes, KEHONG BIO provides custom synthesis services for AB00412065-04 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.