6-Ethyl-3-(1H-tetrazol-5-yl)chromone
TL;DR: 6-Ethyl-3-(1H-tetrazol-5-yl)chromone (CAS 50743-49-2) is a chemical compound with molecular formula C12H10N4O2 and molecular weight 242.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethyl-3-(2H-tetrazol-5-yl)chromen-4-one
Also Known As: 6-ethyl-3- chromone, 6-Ethyl-3-(1H-tetrazol-5-yl)chromone, AA 344, 6-ethyl-3-(2H-tetrazol-5-yl)chromen-4-one, 6-ethyl-3-(1H-tetrazol-5-yl)-chromen-4-one
| Molecular Formula | C12H10N4O2 |
|---|---|
| Molecular Weight | 242.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 80.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.08037 |
| Heavy Atoms | 18 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 50743-49-2 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1)OC=C(C2=O)C3=NNN=N3 |
| InChIKey | UBEONZHRYRTJFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Ethyl-3-(1H-tetrazol-5-yl)chromone (CAS 50743-49-2), with molecular formula C12H10N4O2 and molecular weight 242.08 g/mol. IUPAC: 6-ethyl-3-(2H-tetrazol-5-yl)chromen-4-one.
Chemical Property Profile of 6-Ethyl-3-(1H-tetrazol-5-yl)chromone
Property Insights of 6-Ethyl-3-(1H-tetrazol-5-yl)chromone
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Ethyl-3-(1H-tetrazol-5-yl)chromone. The TPSA of 80.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Ethyl-3-(1H-tetrazol-5-yl)chromone. Following Lipinski's Rule of Five, 6-Ethyl-3-(1H-tetrazol-5-yl)chromone 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 6-Ethyl-3-(1H-tetrazol-5-yl)chromone?
The CAS number of 6-Ethyl-3-(1H-tetrazol-5-yl)chromone is 50743-49-2.
What is the molecular formula of 6-Ethyl-3-(1H-tetrazol-5-yl)chromone?
The molecular formula of 6-Ethyl-3-(1H-tetrazol-5-yl)chromone is C12H10N4O2.
What is the molecular weight of 6-Ethyl-3-(1H-tetrazol-5-yl)chromone?
The molecular weight of 6-Ethyl-3-(1H-tetrazol-5-yl)chromone is 242.08 g/mol.
Where can I buy 6-Ethyl-3-(1H-tetrazol-5-yl)chromone?
You can request a quote for 6-Ethyl-3-(1H-tetrazol-5-yl)chromone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Ethyl-3-(1H-tetrazol-5-yl)chromone?
Yes, KEHONG BIO provides custom synthesis services for 6-Ethyl-3-(1H-tetrazol-5-yl)chromone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.