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
| Molecular Formula | C13H15N5O3S |
| Molecular Weight | 321.08957 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 321.08957 Da |
| Heavy Atoms | 22 |
| Complexity | 482.0 |
| SMILES | CCOC1=CC=CC=C1NC(=O)CSC2=NN=CC(=O)N2N |
| InChIKey | KJDQOKLMJGXZHV-UHFFFAOYSA-N |
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.
The CAS number of AB00676426-01 is 869068-32-6.
The molecular formula of AB00676426-01 is C13H15N5O3S.
The molecular weight of AB00676426-01 is 321.08957 g/mol.
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