2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)-
TL;DR: 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)- (CAS 76239-26-4) is a chemical compound with molecular formula C12H10N4O3 and molecular weight 258.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-ethoxy-3-(2H-tetrazol-5-yl)chromen-2-one
Also Known As: 8-Ethoxy-3-(1H-tetrazol-5-yl)coumarin, 8-ethoxy-3-(2H-tetrazol-5-yl)chromen-2-one, 8-Ethoxy-3-(1H-tetrazol-5-yl)-2H-1-benzopyran-2-one, 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)-, 8-Ethoxy-3-(2H-tetrazol-5-yl)-2H-1-benzopyran-2-one
| Molecular Formula | C12H10N4O3 |
|---|---|
| Molecular Weight | 258.08 g/mol |
| LogP | 1.3718 |
| Topological Polar Surface Area | 93.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.0753 |
| Heavy Atoms | 19 |
| Complexity | 764.2406 |
Chemical Identifiers
| CAS Number | 76239-26-4 |
|---|---|
| SMILES | CCOC1=CC=CC2=C1OC(=O)C(=C2)C3=NNN=N3 |
Product Overview
2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)- (CAS 76239-26-4), with molecular formula C12H10N4O3 and molecular weight 258.08 g/mol. IUPAC: 8-ethoxy-3-(2H-tetrazol-5-yl)chromen-2-one.
Chemical Property Profile of 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)-
Property Insights of 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)-
The XLogP value of 1.3718 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)-. The TPSA of 93.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)-. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)- has 1 hydrogen bond donor(s) and 6 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-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)-?
The CAS number of 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)- is 76239-26-4.
What is the molecular formula of 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)-?
The molecular formula of 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)- is C12H10N4O3.
What is the molecular weight of 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)-?
The molecular weight of 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)- is 258.08 g/mol.
Where can I buy 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)-?
You can request a quote for 2H-1-Benzopyran-2-one, 8-ethoxy-3-(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 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran-2-one, 8-ethoxy-3-(1H-tetrazol-5-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.