4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate
TL;DR: 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate (CAS 858757-67-2) is a chemical compound with molecular formula C28H33NO6 and molecular weight 479.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-butyl-8-methyl-2-oxochromen-7-yl) 6-(phenylmethoxycarbonylamino)hexanoate
Also Known As: 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate, (4-butyl-8-methyl-2-oxo-chromen-7-yl) 6-phenylmethoxycarbonylaminohexanoate, (4-butyl-8-methyl-2-oxochromen-7-yl) 6-(phenylmethoxycarbonylamino)hexanoate, 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate
| Molecular Formula | C28H33NO6 |
|---|---|
| Molecular Weight | 479.23 g/mol |
| LogP | 5.83622 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 479.23077 |
| Heavy Atoms | 35 |
| Complexity | 1185.267 |
Chemical Identifiers
| CAS Number | 858757-67-2 |
|---|---|
| SMILES | CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(=O)CCCCCNC(=O)OCC3=CC=CC=C3 |
Product Overview
4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate (CAS 858757-67-2), with molecular formula C28H33NO6 and molecular weight 479.23 g/mol. IUPAC: (4-butyl-8-methyl-2-oxochromen-7-yl) 6-(phenylmethoxycarbonylamino)hexanoate.
Chemical Property Profile of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate
Property Insights of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate
The XLogP value of 5.83622 indicates that 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate. Following Lipinski's Rule of Five, 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate 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 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate?
The CAS number of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate is 858757-67-2.
What is the molecular formula of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate?
The molecular formula of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate is C28H33NO6.
What is the molecular weight of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate?
The molecular weight of 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate is 479.23 g/mol.
Where can I buy 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate?
You can request a quote for 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate?
Yes, KEHONG BIO provides custom synthesis services for 4-butyl-8-methyl-2-oxo-2H-chromen-7-yl 6-(((benzyloxy)carbonyl)amino)hexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.