1H-Tetrazole, 5-ethyl-1-phenyl-
TL;DR: 1H-Tetrazole, 5-ethyl-1-phenyl- (CAS 46165-47-3) is a chemical compound with molecular formula C9H10N4 and molecular weight 174.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-1-phenyltetrazole
Also Known As: 5-Ethyl-1-phenyl-1H-tetrazole, 1H-Tetrazole, 5-ethyl-1-phenyl-, 5-ethyl-1-phenyltetrazole, 5-26-11-00088 (Beilstein Handbook Reference)
| Molecular Formula | C9H10N4 |
|---|---|
| Molecular Weight | 174.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 174.09055 |
| Heavy Atoms | 13 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 46165-47-3 |
|---|---|
| SMILES | CCC1=NN=NN1C2=CC=CC=C2 |
| InChIKey | WVYXSUZGELRXRA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Tetrazole, 5-ethyl-1-phenyl- (CAS 46165-47-3), with molecular formula C9H10N4 and molecular weight 174.09 g/mol. IUPAC: 5-ethyl-1-phenyltetrazole.
Chemical Property Profile of 1H-Tetrazole, 5-ethyl-1-phenyl-
Property Insights of 1H-Tetrazole, 5-ethyl-1-phenyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Tetrazole, 5-ethyl-1-phenyl-. With a topological polar surface area (TPSA) of 43.6 Ų, 1H-Tetrazole, 5-ethyl-1-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Tetrazole, 5-ethyl-1-phenyl- has 0 hydrogen bond donor(s) and 3 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 1H-Tetrazole, 5-ethyl-1-phenyl-?
The CAS number of 1H-Tetrazole, 5-ethyl-1-phenyl- is 46165-47-3.
What is the molecular formula of 1H-Tetrazole, 5-ethyl-1-phenyl-?
The molecular formula of 1H-Tetrazole, 5-ethyl-1-phenyl- is C9H10N4.
What is the molecular weight of 1H-Tetrazole, 5-ethyl-1-phenyl-?
The molecular weight of 1H-Tetrazole, 5-ethyl-1-phenyl- is 174.09 g/mol.
Where can I buy 1H-Tetrazole, 5-ethyl-1-phenyl-?
You can request a quote for 1H-Tetrazole, 5-ethyl-1-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Tetrazole, 5-ethyl-1-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Tetrazole, 5-ethyl-1-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.