4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate
TL;DR: 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate (CAS 858745-10-5) is a chemical compound with molecular formula C24H25NO6 and molecular weight 423.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-butyl-7-methyl-2-oxochromen-5-yl) 2-(phenylmethoxycarbonylamino)acetate
Also Known As: 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate, (4-butyl-7-methyl-2-oxochromen-5-yl) 2-(phenylmethoxycarbonylamino)acetate, 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl N-[(benzyloxy)carbonyl]glycinate
| Molecular Formula | C24H25NO6 |
|---|---|
| Molecular Weight | 423.17 g/mol |
| LogP | 4.27582 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 423.16818 |
| Heavy Atoms | 31 |
| Complexity | 1120.1128 |
Chemical Identifiers
| CAS Number | 858745-10-5 |
|---|---|
| SMILES | CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)CNC(=O)OCC3=CC=CC=C3 |
Product Overview
4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate (CAS 858745-10-5), with molecular formula C24H25NO6 and molecular weight 423.17 g/mol. IUPAC: (4-butyl-7-methyl-2-oxochromen-5-yl) 2-(phenylmethoxycarbonylamino)acetate.
Chemical Property Profile of 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate
Property Insights of 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate
The XLogP value of 4.27582 indicates that 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate 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-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate. Following Lipinski's Rule of Five, 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate 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 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate?
The CAS number of 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate is 858745-10-5.
What is the molecular formula of 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate?
The molecular formula of 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate is C24H25NO6.
What is the molecular weight of 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate?
The molecular weight of 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate is 423.17 g/mol.
Where can I buy 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate?
You can request a quote for 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-butyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.