![ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate structure](/static/products/6714/6714-80-3.webp)
ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
TL;DR: ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate (CAS 6714-80-3) is a chemical compound with molecular formula C17H17N6O2+ and molecular weight 337.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-methyl-7-quinolin-1-ium-6-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Also Known As: ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate, 6-[6-(Ethoxycarbonyl)-5-methyl-1,7-dihydrotetrazolo[1,5-a]pyrimidin-7-yl]quinolin-1-ium, Ethyl 4-methyl-2-(1H-quinolin-6-yl)-1,5,7,8,9-pentazabicyclo[4.3.0]nona-3,5,7-triene-3-carboxylate
| Molecular Formula | C17H17N6O2+ |
|---|---|
| Molecular Weight | 337.14 g/mol |
| LogP | 1.4924 |
| Topological Polar Surface Area | 96.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.1413 |
| Heavy Atoms | 25 |
| Complexity | 993.47656 |
Chemical Identifiers
| CAS Number | 6714-80-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=NN=NN2C1C3=CC4=C(C=C3)[NH+]=CC=C4)C |
Product Overview
ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate (CAS 6714-80-3), with molecular formula C17H17N6O2+ and molecular weight 337.14 g/mol. IUPAC: ethyl 5-methyl-7-quinolin-1-ium-6-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate.
Chemical Property Profile of ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Property Insights of ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
The XLogP value of 1.4924 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate. The TPSA of 96.07 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate. Following Lipinski's Rule of Five, ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate has 1 hydrogen bond donor(s) and 6 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 ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate?
The CAS number of ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate is 6714-80-3.
What is the molecular formula of ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate?
The molecular formula of ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate is C17H17N6O2+.
What is the molecular weight of ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate?
The molecular weight of ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate is 337.14 g/mol.
Where can I buy ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate?
You can request a quote for ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.