4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)-
TL;DR: 4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)- (CAS 3833-52-1) is a chemical compound with molecular formula C11H8N4O2 and molecular weight 228.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methyl-2-(2H-tetrazol-5-yl)chromen-4-one
Also Known As: 2-(Tetrazol-5-yl)-7-methyl-chromon, 4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)-, 8-Methyl-2-(1H-tetrazol-5-yl)-4H-1-benzopyran-4-one, 8-methyl-2-(2h-tetrazol-5-yl)-4h-chromen-4-one, 8-methyl-2-(2H-tetrazol-5-yl)chromen-4-one
| Molecular Formula | C11H8N4O2 |
|---|---|
| Molecular Weight | 228.06 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 80.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.06473 |
| Heavy Atoms | 17 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 3833-52-1 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C(=O)C=C(O2)C3=NNN=N3 |
| InChIKey | JJYZKDKAKOHVRX-UHFFFAOYSA-N |
Product Overview
4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)- (CAS 3833-52-1), with molecular formula C11H8N4O2 and molecular weight 228.06 g/mol. IUPAC: 8-methyl-2-(2H-tetrazol-5-yl)chromen-4-one.
Chemical Property Profile of 4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)-
Property Insights of 4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1-Benzopyran-4-one, 8-methyl-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, 8-methyl-2-(1H-tetrazol-5-yl)-. Following Lipinski's Rule of Five, 4H-1-Benzopyran-4-one, 8-methyl-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, 8-methyl-2-(1H-tetrazol-5-yl)-?
The CAS number of 4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)- is 3833-52-1.
What is the molecular formula of 4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)-?
The molecular formula of 4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)- is C11H8N4O2.
What is the molecular weight of 4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)-?
The molecular weight of 4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)- is 228.06 g/mol.
Where can I buy 4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)-?
You can request a quote for 4H-1-Benzopyran-4-one, 8-methyl-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, 8-methyl-2-(1H-tetrazol-5-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1-Benzopyran-4-one, 8-methyl-2-(1H-tetrazol-5-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.