AB00667594-01
TL;DR: AB00667594-01 (CAS 301679-35-6) is a chemical compound with molecular formula C10H9N5O3S and molecular weight 279.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-N-[(E)-thiophen-2-ylmethylideneamino]acetamide
Also Known As: AB00667594-01, 2-(3,5-dihydroxy-1,2,4-triazin-6-yl)-N'-[(E)-thiophen-2-ylmethylidene]acetohydrazide, 2-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-N-[(E)-thiophen-2-ylmethylideneamino]acetamide, N-((1E)-2-(2-thienyl)-1-azavinyl)-2-(3,5-dioxo(2H,4H-1,2,4-triazin-6-yl))aceta mide, (E)-2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N'-(thiophen-2-ylmethylene)acetohydrazide
| Molecular Formula | C10H9N5O3S |
|---|---|
| Molecular Weight | 279.04 g/mol |
| LogP | -0.7875 |
| Topological Polar Surface Area | 120.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.0426 |
| Heavy Atoms | 19 |
| Complexity | 700.4504 |
Chemical Identifiers
| CAS Number | 301679-35-6 |
|---|---|
| SMILES | C1=CSC(=C1)/C=N/NC(=O)CC2=NNC(=O)NC2=O |
Product Overview
AB00667594-01 (CAS 301679-35-6), with molecular formula C10H9N5O3S and molecular weight 279.04 g/mol. IUPAC: 2-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-N-[(E)-thiophen-2-ylmethylideneamino]acetamide.
Chemical Property Profile of AB00667594-01
Property Insights of AB00667594-01
The XLogP value of -0.7875 indicates that AB00667594-01 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.07 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00667594-01. Following Lipinski's Rule of Five, AB00667594-01 has 3 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 AB00667594-01?
The CAS number of AB00667594-01 is 301679-35-6.
What is the molecular formula of AB00667594-01?
The molecular formula of AB00667594-01 is C10H9N5O3S.
What is the molecular weight of AB00667594-01?
The molecular weight of AB00667594-01 is 279.04 g/mol.
Where can I buy AB00667594-01?
You can request a quote for AB00667594-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00667594-01?
Yes, KEHONG BIO provides custom synthesis services for AB00667594-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.