3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one
TL;DR: 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one (CAS 76239-39-9) is a chemical compound with molecular formula C25H30N4O3 and molecular weight 434.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one
Also Known As: 8-Farnesyloxy-3-(1H-tetrazol-5-yl)coumarin, 3-(1H-Tetrazol-5-yl)-8-((3,7,11-trimethyl-2,6,10-dodecatrienyl)oxy)-2H-1-benzopyran-2-one, 2H-1-Benzopyran-2-one, 3-(1H-tetrazol-5-yl)-8-((3,7,11-trimethyl-2,6,10-dodecatrienyl)oxy)-
| Molecular Formula | C25H30N4O3 |
|---|---|
| Molecular Weight | 434.23 g/mol |
| LogP | 5.7711 |
| Topological Polar Surface Area | 93.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 434.23178 |
| Heavy Atoms | 32 |
| Complexity | 1183.6174 |
Chemical Identifiers
| CAS Number | 76239-39-9 |
|---|---|
| SMILES | CC(=CCCC(=CCCC(=CCOC1=CC=CC2=C1OC(=O)C(=C2)C3=NNN=N3)C)C)C |
Product Overview
3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one (CAS 76239-39-9), with molecular formula C25H30N4O3 and molecular weight 434.23 g/mol. IUPAC: 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one.
Chemical Property Profile of 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one
Property Insights of 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one
The XLogP value of 5.7711 indicates that 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one. Following Lipinski's Rule of Five, 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one?
The CAS number of 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one is 76239-39-9.
What is the molecular formula of 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one?
The molecular formula of 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one is C25H30N4O3.
What is the molecular weight of 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one?
The molecular weight of 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one is 434.23 g/mol.
Where can I buy 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one?
You can request a quote for 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)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-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2H-tetrazol-5-yl)-8-(3,7,11-trimethyldodeca-2,6,10-trienoxy)chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.