5-(1-Piperazinyl)-isoquinoline Hydrochloride
TL;DR: 5-(1-Piperazinyl)-isoquinoline Hydrochloride (CAS 168152-94-1) is a chemical compound with molecular formula C27H29N9 and molecular weight 479.25458 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-piperidin-1-yl-7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyrimidine
Also Known As: 5-(1-Piperazinyl)-isoquinoline Hydrochloride, (1,2,4)Triazolo(1,5-a)pyrimidine, 5-(1-piperidinyl)-7-propyl-6-((2'-(1H-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)-, 5-piperidin-1-yl-7-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyrimidine, [1,2,4]Triazolo[1,5-a]pyrimidine,5-(1-piperidinyl)-7-propyl-6-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-, 5-(Piperidin-1-yl)-7-propyl-6-{[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl}[1,2,4]triazolo[1,5-a]pyrimidine
Technical Specifications
| Molecular Formula | C27H29N9 |
| Molecular Weight | 479.25458 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 479.25458 Da |
| Heavy Atoms | 36 |
| Complexity | 680.0 |
| SMILES | CCCC1=C(C(=NC2=NC=NN12)N3CCCCC3)CC4=CC=C(C=C4)C5=CC=CC=C5C6=NNN=N6 |
| InChIKey | YGNZIYDTDDSIEA-UHFFFAOYSA-N |
Chemical Property Profile of 5-(1-Piperazinyl)-isoquinoline Hydrochloride
Property Insights of 5-(1-Piperazinyl)-isoquinoline Hydrochloride
The XLogP value of 5.3 indicates that 5-(1-Piperazinyl)-isoquinoline Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(1-Piperazinyl)-isoquinoline Hydrochloride. Following Lipinski's Rule of Five, 5-(1-Piperazinyl)-isoquinoline Hydrochloride has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 5-(1-Piperazinyl)-isoquinoline Hydrochloride?
The CAS number of 5-(1-Piperazinyl)-isoquinoline Hydrochloride is 168152-94-1.
What is the molecular formula of 5-(1-Piperazinyl)-isoquinoline Hydrochloride?
The molecular formula of 5-(1-Piperazinyl)-isoquinoline Hydrochloride is C27H29N9.
What is the molecular weight of 5-(1-Piperazinyl)-isoquinoline Hydrochloride?
The molecular weight of 5-(1-Piperazinyl)-isoquinoline Hydrochloride is 479.25458 g/mol.
Where can I buy 5-(1-Piperazinyl)-isoquinoline Hydrochloride?
You can request a quote for 5-(1-Piperazinyl)-isoquinoline Hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(1-Piperazinyl)-isoquinoline Hydrochloride?
Yes, CoreyChem provides custom synthesis services for 5-(1-Piperazinyl)-isoquinoline Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.