3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid
TL;DR: 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid (CAS 438220-74-7) is a chemical compound with molecular formula C18H20N4O2 and molecular weight 324.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-phenyltetrazol-2-yl)adamantane-1-carboxylic acid
Also Known As: 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid, 3-(5-phenyltetrazol-2-yl)adamantane-1-carboxylic Acid, 3-(5-Phenyl-2H-tetraazol-2-yl)adamantane-1-carboxylic acid, 3-(5-Phenyl-2h-1,2,3,4-tetrazol-2-yl)adamantane-1-carboxylic acid, 3-(5-phenyl-1,2,3,4-tetraazol-2-yl)adamantanecarboxylic acid
| Molecular Formula | C18H20N4O2 |
|---|---|
| Molecular Weight | 324.16 g/mol |
| LogP | 2.7202 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.15863 |
| Heavy Atoms | 24 |
| Complexity | 786.3599 |
Chemical Identifiers
| CAS Number | 438220-74-7 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)N4N=C(N=N4)C5=CC=CC=C5)C(=O)O |
Product Overview
3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid (CAS 438220-74-7), with molecular formula C18H20N4O2 and molecular weight 324.16 g/mol. IUPAC: 3-(5-phenyltetrazol-2-yl)adamantane-1-carboxylic acid.
Chemical Property Profile of 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid
Property Insights of 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid
The XLogP value of 2.7202 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid. Following Lipinski's Rule of Five, 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid has 1 hydrogen bond donor(s) and 4 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 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid?
The CAS number of 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid is 438220-74-7.
What is the molecular formula of 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid?
The molecular formula of 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid is C18H20N4O2.
What is the molecular weight of 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid?
The molecular weight of 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid is 324.16 g/mol.
Where can I buy 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid?
You can request a quote for 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Phenyl-tetrazol-2-yl)-adamantane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.