3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one
TL;DR: 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one (CAS 849005-79-4) is a chemical compound with molecular formula C14H14N4O3 and molecular weight 286.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,7-trimethyl-5-(2H-tetrazol-5-ylmethoxy)chromen-2-one
Also Known As: EiM07-19284, 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one, AB01269536-02, 3,4,7-trimethyl-5-(2H-tetrazol-5-ylmethoxy)chromen-2-one, 5-((2H-tetrazol-5-yl)methoxy)-3,4,7-trimethyl-2H-chromen-2-one
| Molecular Formula | C14H14N4O3 |
|---|---|
| Molecular Weight | 286.11 g/mol |
| LogP | 1.81036 |
| Topological Polar Surface Area | 93.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.1066 |
| Heavy Atoms | 21 |
| Complexity | 852.7719 |
Chemical Identifiers
| CAS Number | 849005-79-4 |
|---|---|
| SMILES | CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1)OCC3=NNN=N3 |
Product Overview
3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one (CAS 849005-79-4), with molecular formula C14H14N4O3 and molecular weight 286.11 g/mol. IUPAC: 3,4,7-trimethyl-5-(2H-tetrazol-5-ylmethoxy)chromen-2-one.
Chemical Property Profile of 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one
Property Insights of 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one
The XLogP value of 1.81036 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one. The TPSA of 93.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one. Following Lipinski's Rule of Five, 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one 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 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one?
The CAS number of 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one is 849005-79-4.
What is the molecular formula of 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one?
The molecular formula of 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one is C14H14N4O3.
What is the molecular weight of 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one?
The molecular weight of 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one is 286.11 g/mol.
Where can I buy 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one?
You can request a quote for 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3,4,7-trimethyl-5-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.