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AB00676426-01 structure
Fine Chemical

AB00676426-01

TL;DR: AB00676426-01 (CAS 869068-32-6) is a chemical compound with molecular formula C13H15N5O3S and molecular weight 321.08957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(4-amino-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-(2-ethoxyphenyl)acetamide

Also Known As: AB00676426-01, F1847-0158, 2-((4-amino-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)thio)-N-(2-ethoxyphenyl)acetamide, 2-[(4-amino-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)sulfanyl]-N-(2-ethoxyphenyl)acetamide, 2-[(4-amino-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-(2-ethoxyphenyl)acetamide

CAS Number
869068-32-6
Molecular Formula
C13H15N5O3S
Molecular Weight
321.08957 g/mol
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Technical Specifications

Molecular FormulaC13H15N5O3S
Molecular Weight321.08957 g/mol
XLogP1.0
Topological Polar Surface Area (TPSA)135.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors7
Rotatable Bonds6
Exact Mass321.08957 Da
Heavy Atoms22
Complexity482.0
SMILESCCOC1=CC=CC=C1NC(=O)CSC2=NN=CC(=O)N2N
InChIKeyKJDQOKLMJGXZHV-UHFFFAOYSA-N

Chemical Property Profile of AB00676426-01

XLogP
1.0
TPSA (Topological Polar Surface Area)
135.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
6
Heavy Atoms
22
Complexity
482.0
Exact Mass
321.08957
Monoisotopic Mass
321.08957
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of AB00676426-01

The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00676426-01. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00676426-01. Following Lipinski's Rule of Five, AB00676426-01 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of AB00676426-01?

The CAS number of AB00676426-01 is 869068-32-6.

What is the molecular formula of AB00676426-01?

The molecular formula of AB00676426-01 is C13H15N5O3S.

What is the molecular weight of AB00676426-01?

The molecular weight of AB00676426-01 is 321.08957 g/mol.

Where can I buy AB00676426-01?

You can request a quote for AB00676426-01 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for AB00676426-01?

Yes, CoreyChem provides custom synthesis services for AB00676426-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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