2H-Tetrazole, 5-phenyl-, calcium salt (2:1)
TL;DR: 2H-Tetrazole, 5-phenyl-, calcium salt (2:1) (CAS 55719-89-6) is a chemical compound with molecular formula C14H10CaN8 and molecular weight 330.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium bis(5-phenyl-1,2,3-triaza-4-azanidacyclopenta-2,5-diene)
Also Known As: 5-Phenyltetrazole, calcium salt, 1H-Tetrazole, 5-phenyl-, calcium salt, 5-Phenyl-1H-tetrazole, calcium salt, C7H6N4.1/2Ca, C7-H6-N4.1/2Ca
| Molecular Formula | C14H10CaN8 |
|---|---|
| Molecular Weight | 330.07 g/mol |
| LogP | 0.61 |
| Topological Polar Surface Area | 79.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.06543 |
| Heavy Atoms | 23 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 55719-89-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN=N[N-]2.C1=CC=C(C=C1)C2=NN=N[N-]2.[Ca+2] |
| InChIKey | LIQUIQYZHDBODX-UHFFFAOYSA-N |
Product Overview
2H-Tetrazole, 5-phenyl-, calcium salt (2:1) (CAS 55719-89-6), with molecular formula C14H10CaN8 and molecular weight 330.07 g/mol. IUPAC: calcium bis(5-phenyl-1,2,3-triaza-4-azanidacyclopenta-2,5-diene).
Chemical Property Profile of 2H-Tetrazole, 5-phenyl-, calcium salt (2:1)
Property Insights of 2H-Tetrazole, 5-phenyl-, calcium salt (2:1)
The XLogP value of 0.61 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Tetrazole, 5-phenyl-, calcium salt (2:1). The TPSA of 79.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Tetrazole, 5-phenyl-, calcium salt (2:1). Following Lipinski's Rule of Five, 2H-Tetrazole, 5-phenyl-, calcium salt (2:1) has 0 hydrogen bond donor(s) and 8 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 2H-Tetrazole, 5-phenyl-, calcium salt (2:1)?
The CAS number of 2H-Tetrazole, 5-phenyl-, calcium salt (2:1) is 55719-89-6.
What is the molecular formula of 2H-Tetrazole, 5-phenyl-, calcium salt (2:1)?
The molecular formula of 2H-Tetrazole, 5-phenyl-, calcium salt (2:1) is C14H10CaN8.
What is the molecular weight of 2H-Tetrazole, 5-phenyl-, calcium salt (2:1)?
The molecular weight of 2H-Tetrazole, 5-phenyl-, calcium salt (2:1) is 330.07 g/mol.
Where can I buy 2H-Tetrazole, 5-phenyl-, calcium salt (2:1)?
You can request a quote for 2H-Tetrazole, 5-phenyl-, calcium salt (2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Tetrazole, 5-phenyl-, calcium salt (2:1)?
Yes, KEHONG BIO provides custom synthesis services for 2H-Tetrazole, 5-phenyl-, calcium salt (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.