AB00676436-01
TL;DR: AB00676436-01 (CAS 869068-50-8) is a chemical compound with molecular formula C13H14N6O3S and molecular weight 334.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-acetamidophenyl)-2-[(4-amino-5-oxo-1,2,4-triazin-3-yl)sulfanyl]acetamide
Also Known As: AB00676436-01, F1847-0176, 2-[(4-amino-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)sulfanyl]-N-(3-acetamidophenyl)acetamide, N-(3-acetamidophenyl)-2-((4-amino-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)thio)acetamide, N-(3-acetamidophenyl)-2-[(4-amino-5-oxo-1,2,4-triazin-3-yl)sulfanyl]acetamide
| Molecular Formula | C13H14N6O3S |
|---|---|
| Molecular Weight | 334.08 g/mol |
| LogP | 0.0413 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.0848 |
| Heavy Atoms | 23 |
| Complexity | 791.2745 |
Chemical Identifiers
| CAS Number | 869068-50-8 |
|---|---|
| SMILES | CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NN=CC(=O)N2N |
Product Overview
AB00676436-01 (CAS 869068-50-8), with molecular formula C13H14N6O3S and molecular weight 334.08 g/mol. IUPAC: N-(3-acetamidophenyl)-2-[(4-amino-5-oxo-1,2,4-triazin-3-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00676436-01
Property Insights of AB00676436-01
The XLogP value of 0.0413 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00676436-01. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00676436-01. Following Lipinski's Rule of Five, AB00676436-01 has 3 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 AB00676436-01?
The CAS number of AB00676436-01 is 869068-50-8.
What is the molecular formula of AB00676436-01?
The molecular formula of AB00676436-01 is C13H14N6O3S.
What is the molecular weight of AB00676436-01?
The molecular weight of AB00676436-01 is 334.08 g/mol.
Where can I buy AB00676436-01?
You can request a quote for AB00676436-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00676436-01?
Yes, KEHONG BIO provides custom synthesis services for AB00676436-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.