AP-828/41023766
TL;DR: AP-828/41023766 (CAS 443293-12-7) is a chemical compound with molecular formula C14H14N6OS2 and molecular weight 346.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
Also Known As: AP-828/41023766, 2-[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)acetamide, 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)acetamide, 2-((4-amino-5-methyl-4H-1,2,4-triazol-3-yl)thio)-N-(4-phenylthiazol-2-yl)acetamide, 2-[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[(2E)-4-phenyl-1,3-thiazol-2(3H)-ylidene]acetamide
| Molecular Formula | C14H14N6OS2 |
|---|---|
| Molecular Weight | 346.07 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 346.06705 |
| Heavy Atoms | 23 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 443293-12-7 |
|---|---|
| SMILES | CC1=NN=C(N1N)SCC(=O)NC2=NC(=CS2)C3=CC=CC=C3 |
| InChIKey | JMVXNTYGCYBWJR-UHFFFAOYSA-N |
Product Overview
AP-828/41023766 (CAS 443293-12-7), with molecular formula C14H14N6OS2 and molecular weight 346.07 g/mol. IUPAC: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of AP-828/41023766
Property Insights of AP-828/41023766
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AP-828/41023766. The TPSA of 152.0 Ų indicates high polarity, suggesting AP-828/41023766 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AP-828/41023766 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
Frequently Asked Questions
What is the CAS number of AP-828/41023766?
The CAS number of AP-828/41023766 is 443293-12-7.
What is the molecular formula of AP-828/41023766?
The molecular formula of AP-828/41023766 is C14H14N6OS2.
What is the molecular weight of AP-828/41023766?
The molecular weight of AP-828/41023766 is 346.07 g/mol.
Where can I buy AP-828/41023766?
You can request a quote for AP-828/41023766 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-828/41023766?
Yes, KEHONG BIO provides custom synthesis services for AP-828/41023766 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.