AB00491117-08
TL;DR: AB00491117-08 (CAS 1209984-63-3) is a chemical compound with molecular formula C18H19N7OS3 and molecular weight 445.08133 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[4-ethyl-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide
Also Known As: AB00491117-08, F0653-0206, 2-((4-ethyl-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(5-(ethylthio)-1,3,4-thiadiazol-2-yl)acetamide, 2-{[4-ethyl-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide, 2-[(4-ethyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide
Technical Specifications
| Molecular Formula | C18H19N7OS3 |
| Molecular Weight | 445.08133 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 180.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 445.08133 Da |
| Heavy Atoms | 29 |
| Complexity | 560.0 |
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=NN=C(S2)SCC)C3=CNC4=CC=CC=C43 |
| InChIKey | NRBAJRJDPABVLI-UHFFFAOYSA-N |
Chemical Property Profile of AB00491117-08
Property Insights of AB00491117-08
The XLogP value of 3.3 indicates that AB00491117-08 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 180.0 Ų indicates high polarity, suggesting AB00491117-08 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AB00491117-08 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of AB00491117-08?
The CAS number of AB00491117-08 is 1209984-63-3.
What is the molecular formula of AB00491117-08?
The molecular formula of AB00491117-08 is C18H19N7OS3.
What is the molecular weight of AB00491117-08?
The molecular weight of AB00491117-08 is 445.08133 g/mol.
Where can I buy AB00491117-08?
You can request a quote for AB00491117-08 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AB00491117-08?
Yes, CoreyChem provides custom synthesis services for AB00491117-08 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.