3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate
TL;DR: 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate (CAS 858742-75-3) is a chemical compound with molecular formula C22H21NO6 and molecular weight 395.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4,8-trimethyl-2-oxochromen-7-yl) 2-(phenylmethoxycarbonylamino)acetate
Also Known As: 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate, (3,4,8-trimethyl-2-oxochromen-7-yl) 2-(phenylmethoxycarbonylamino)acetate, 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl N-[(benzyloxy)carbonyl]glycinate
| Molecular Formula | C22H21NO6 |
|---|---|
| Molecular Weight | 395.14 g/mol |
| LogP | 3.55006 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.1369 |
| Heavy Atoms | 29 |
| Complexity | 1117.591 |
Chemical Identifiers
| CAS Number | 858742-75-3 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(=O)CNC(=O)OCC3=CC=CC=C3)C |
Product Overview
3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate (CAS 858742-75-3), with molecular formula C22H21NO6 and molecular weight 395.14 g/mol. IUPAC: (3,4,8-trimethyl-2-oxochromen-7-yl) 2-(phenylmethoxycarbonylamino)acetate.
Chemical Property Profile of 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate
Property Insights of 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate
The XLogP value of 3.55006 indicates that 3,4,8-trimethyl-2-oxo-2H-chromen-7-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 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate. Following Lipinski's Rule of Five, 3,4,8-trimethyl-2-oxo-2H-chromen-7-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 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate?
The CAS number of 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate is 858742-75-3.
What is the molecular formula of 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate?
The molecular formula of 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate is C22H21NO6.
What is the molecular weight of 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate?
The molecular weight of 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate is 395.14 g/mol.
Where can I buy 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate?
You can request a quote for 3,4,8-trimethyl-2-oxo-2H-chromen-7-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 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate?
Yes, KEHONG BIO provides custom synthesis services for 3,4,8-trimethyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.