4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)-
TL;DR: 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)- (CAS 3832-69-7) 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.
2-(2H-tetrazol-5-yl)chromen-4-one
Also Known As: 2-(2H-tetrazol-5-yl)chromen-4-one, 2-(1H-Tetrazol-5-yl)-4H-1-benzopyran-4-one, 2-(5-tetrazolyl)benzopyran-4-one, 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)-, 2-(1H-tetraazol-5-yl)-4H-chromen-4-one
| 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 | 3832-69-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C=C(O2)C3=NNN=N3 |
| InChIKey | ZZLXVXGOFGHKHP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)- (CAS 3832-69-7), with molecular formula C10H6N4O2 and molecular weight 214.05 g/mol. IUPAC: 2-(2H-tetrazol-5-yl)chromen-4-one.
Chemical Property Profile of 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)-
Property Insights of 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)-. The TPSA of 80.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)-. Following Lipinski's Rule of Five, 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)- 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 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)-?
The CAS number of 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)- is 3832-69-7.
What is the molecular formula of 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)-?
The molecular formula of 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)- is C10H6N4O2.
What is the molecular weight of 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)-?
The molecular weight of 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)- is 214.05 g/mol.
Where can I buy 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)-?
You can request a quote for 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1-Benzopyran-4-one, 2-(1H-tetrazol-5-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.