3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate
TL;DR: 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate (CAS 637751-17-8) is a chemical compound with molecular formula C20H18BrNO5 and molecular weight 431.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2-bromophenoxy)-4-oxochromen-7-yl] N,N-diethylcarbamate
Also Known As: 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate, VU0616608-1, [3-(2-bromophenoxy)-4-oxochromen-7-yl] N,N-diethylcarbamate, AF-399/42316188, 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl N,N-diethylcarbamate
| Molecular Formula | C20H18BrNO5 |
|---|---|
| Molecular Weight | 431.04 g/mol |
| LogP | 5.1884 |
| Topological Polar Surface Area | 68.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.03683 |
| Heavy Atoms | 27 |
| Complexity | 1026.3009 |
Chemical Identifiers
| CAS Number | 637751-17-8 |
|---|---|
| SMILES | CCN(CC)C(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3Br |
Product Overview
3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate (CAS 637751-17-8), with molecular formula C20H18BrNO5 and molecular weight 431.04 g/mol. IUPAC: [3-(2-bromophenoxy)-4-oxochromen-7-yl] N,N-diethylcarbamate.
Chemical Property Profile of 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate
Property Insights of 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate
The XLogP value of 5.1884 indicates that 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate. Following Lipinski's Rule of Five, 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate 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 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate?
The CAS number of 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate is 637751-17-8.
What is the molecular formula of 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate?
The molecular formula of 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate is C20H18BrNO5.
What is the molecular weight of 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate?
The molecular weight of 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate is 431.04 g/mol.
Where can I buy 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate?
You can request a quote for 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl diethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.