3-tetrazolylchromone
TL;DR: 3-tetrazolylchromone (CAS 50743-45-8) is a chemical compound with molecular formula C10H6N4O2 and molecular weight 214.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2H-tetrazol-5-yl)chromen-4-one
Also Known As: 3-tetrazolylchromone, Maybridge4_003007, 3-(2H-tetrazol-5-yl)chromen-4-one, 3-(1H-tetrazol-5-yl)-4H-chromen-4-one, 3-(1H-tetrazol-5-yl) chromone
| Molecular Formula | C10H6N4O2 |
|---|---|
| Molecular Weight | 214.05 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 80.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 214.04907 |
| Heavy Atoms | 16 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 50743-45-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=CO2)C3=NNN=N3 |
| InChIKey | HJOBCUUZGWRLTO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-tetrazolylchromone (CAS 50743-45-8), with molecular formula C10H6N4O2 and molecular weight 214.05 g/mol. IUPAC: 3-(2H-tetrazol-5-yl)chromen-4-one.
Chemical Property Profile of 3-tetrazolylchromone
Property Insights of 3-tetrazolylchromone
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-tetrazolylchromone. The TPSA of 80.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-tetrazolylchromone. Following Lipinski's Rule of Five, 3-tetrazolylchromone has 1 hydrogen bond donor(s) and 5 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-tetrazolylchromone?
The CAS number of 3-tetrazolylchromone is 50743-45-8.
What is the molecular formula of 3-tetrazolylchromone?
The molecular formula of 3-tetrazolylchromone is C10H6N4O2.
What is the molecular weight of 3-tetrazolylchromone?
The molecular weight of 3-tetrazolylchromone is 214.05 g/mol.
Where can I buy 3-tetrazolylchromone?
You can request a quote for 3-tetrazolylchromone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-tetrazolylchromone?
Yes, KEHONG BIO provides custom synthesis services for 3-tetrazolylchromone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.