2,2':5',2''-Terthiophene,3',4'-dihexyl
TL;DR: 2,2':5',2''-Terthiophene,3',4'-dihexyl (CAS 151327-13-8) is a chemical compound with molecular formula C22H20N8O and molecular weight 412.176 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-[1,2,4]triazolo[4,3-a]pyrimidin-5-one
Also Known As: 2,2':5',2''-Terthiophene,3',4'-dihexyl, 7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-[1,2,4]triazolo[4,3-a]pyrimidin-5-one, (1,2,4)Triazolo(4,3-a)pyrimidin-5-ol, 7-propyl-6-((2'-(1H-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)-, 1,2,4-Triazolo[4,3-a]pyrimidin-5-ol,7-propyl-6-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-, 7-Propyl-6-((2/'-(1H-tetrazol-5-yl)(1,1/'-biphenyl)-4-yl)methyl)-s-triazolo(4,3-a)pyrimidin-5-ol
Technical Specifications
| Molecular Formula | C22H20N8O |
| Molecular Weight | 412.176 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.176 Da |
| Heavy Atoms | 31 |
| Complexity | 769.0 |
| SMILES | CCCC1=C(C(=O)N2C=NNC2=N1)CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5 |
| InChIKey | ONQSJAULSZBAGS-UHFFFAOYSA-N |
Chemical Property Profile of 2,2':5',2''-Terthiophene,3',4'-dihexyl
Property Insights of 2,2':5',2''-Terthiophene,3',4'-dihexyl
The XLogP value of 3.1 indicates that 2,2':5',2''-Terthiophene,3',4'-dihexyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2':5',2''-Terthiophene,3',4'-dihexyl. Following Lipinski's Rule of Five, 2,2':5',2''-Terthiophene,3',4'-dihexyl has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,2':5',2''-Terthiophene,3',4'-dihexyl?
The CAS number of 2,2':5',2''-Terthiophene,3',4'-dihexyl is 151327-13-8.
What is the molecular formula of 2,2':5',2''-Terthiophene,3',4'-dihexyl?
The molecular formula of 2,2':5',2''-Terthiophene,3',4'-dihexyl is C22H20N8O.
What is the molecular weight of 2,2':5',2''-Terthiophene,3',4'-dihexyl?
The molecular weight of 2,2':5',2''-Terthiophene,3',4'-dihexyl is 412.176 g/mol.
Where can I buy 2,2':5',2''-Terthiophene,3',4'-dihexyl?
You can request a quote for 2,2':5',2''-Terthiophene,3',4'-dihexyl directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2':5',2''-Terthiophene,3',4'-dihexyl?
Yes, CoreyChem provides custom synthesis services for 2,2':5',2''-Terthiophene,3',4'-dihexyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.