![ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate structure](/static/products/896/896824-75-2.png)
ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate
TL;DR: ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate (CAS 896824-75-2) is a chemical compound with molecular formula C21H31N5O3 and molecular weight 401.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate
Also Known As: ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate, ethyl 1-((1r,3s,5R,7S)-3-(5-methyl-2H-tetrazol-2-yl)adamantane-1-carbonyl)piperidine-4-carboxylate, ethyl 1-{[3-(5-methyl-2H-tetrazol-2-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]carbonyl}piperidine-4-carboxylate
| Molecular Formula | C21H31N5O3 |
|---|---|
| Molecular Weight | 401.24 g/mol |
| LogP | 2.07872 |
| Topological Polar Surface Area | 90.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.24268 |
| Heavy Atoms | 29 |
| Complexity | 798.9935 |
Chemical Identifiers
| CAS Number | 896824-75-2 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)C(=O)C23CC4CC(C2)CC(C4)(C3)N5N=C(N=N5)C |
Product Overview
ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate (CAS 896824-75-2), with molecular formula C21H31N5O3 and molecular weight 401.24 g/mol. IUPAC: ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate.
Chemical Property Profile of ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate
Property Insights of ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate
The XLogP value of 2.07872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate. The TPSA of 90.21 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate. Following Lipinski's Rule of Five, ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate has 0 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 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate?
The CAS number of ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate is 896824-75-2.
What is the molecular formula of ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate?
The molecular formula of ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate is C21H31N5O3.
What is the molecular weight of ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate?
The molecular weight of ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate is 401.24 g/mol.
Where can I buy ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate?
You can request a quote for ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 1-[3-(5-methyltetrazol-2-yl)adamantane-1-carbonyl]piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.