2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate
TL;DR: 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate (CAS 314243-84-0) is a chemical compound with molecular formula C28H32N2O4 and molecular weight 460.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-tert-butyl-6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxochromen-7-yl] 2,2-dimethylpropanoate
Also Known As: 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate, [2-tert-butyl-6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxochromen-7-yl] 2,2-dimethylpropanoate, [6-ethyl-3-(1-methylbenzoimidazol-2-yl)-4-oxo-2-tert-butyl-chromen-7-yl] 2,2-dimethylpropanoate, 2-(tert-butyl)-6-ethyl-3-(1-methyl-1H-benzo[d]imidazol-2-yl)-4-oxo-4H-chromen-7-yl pivalate, 2-(tert-butyl)-6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxochromen-7-yl 2,2-dim ethylpropanoate
| Molecular Formula | C28H32N2O4 |
|---|---|
| Molecular Weight | 460.24 g/mol |
| LogP | 6.1581 |
| Topological Polar Surface Area | 74.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 460.2362 |
| Heavy Atoms | 34 |
| Complexity | 1477.0736 |
Chemical Identifiers
| CAS Number | 314243-84-0 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1OC(=O)C(C)(C)C)OC(=C(C2=O)C3=NC4=CC=CC=C4N3C)C(C)(C)C |
Product Overview
2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate (CAS 314243-84-0), with molecular formula C28H32N2O4 and molecular weight 460.24 g/mol. IUPAC: [2-tert-butyl-6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxochromen-7-yl] 2,2-dimethylpropanoate.
Chemical Property Profile of 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate
Property Insights of 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate
The XLogP value of 6.1581 indicates that 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate. Following Lipinski's Rule of Five, 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate?
The CAS number of 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate is 314243-84-0.
What is the molecular formula of 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate?
The molecular formula of 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate is C28H32N2O4.
What is the molecular weight of 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate?
The molecular weight of 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate is 460.24 g/mol.
Where can I buy 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate?
You can request a quote for 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate?
Yes, KEHONG BIO provides custom synthesis services for 2-t-butyl-3-(1-methyl-1h-benzimidazol-2-yl)-6-ethyl-4-oxo-4h-chromen-7-yl pivalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.