7-Diethylamino-3,3'-carbonylbiscoumarine
TL;DR: 7-Diethylamino-3,3'-carbonylbiscoumarine (CAS 83179-57-1) is a chemical compound with molecular formula C23H19NO5 and molecular weight 389.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(diethylamino)-3-(2-oxochromene-3-carbonyl)chromen-2-one
Also Known As: 7-Diethylamino-3,3'-carbonylbiscoumarine, J1.068.183I, 7-diethylamino-3-(2-oxochromene-3-carbonyl)chromen-2-one, 7-(diethylamino)-3-(2-oxochromene-3-carbonyl)chromen-2-one, 7-(Diethylamino)[3,3 -carbonylbis(2H-1-benzopyran-2-one)]
| Molecular Formula | C23H19NO5 |
|---|---|
| Molecular Weight | 389.13 g/mol |
| LogP | 3.9766 |
| Topological Polar Surface Area | 80.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.1263 |
| Heavy Atoms | 29 |
| Complexity | 1344.9854 |
Chemical Identifiers
| CAS Number | 83179-57-1 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C3=CC4=CC=CC=C4OC3=O |
Product Overview
7-Diethylamino-3,3'-carbonylbiscoumarine (CAS 83179-57-1), with molecular formula C23H19NO5 and molecular weight 389.13 g/mol. IUPAC: 7-(diethylamino)-3-(2-oxochromene-3-carbonyl)chromen-2-one.
Chemical Property Profile of 7-Diethylamino-3,3'-carbonylbiscoumarine
Property Insights of 7-Diethylamino-3,3'-carbonylbiscoumarine
The XLogP value of 3.9766 indicates that 7-Diethylamino-3,3'-carbonylbiscoumarine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Diethylamino-3,3'-carbonylbiscoumarine. Following Lipinski's Rule of Five, 7-Diethylamino-3,3'-carbonylbiscoumarine has 0 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 7-Diethylamino-3,3'-carbonylbiscoumarine?
The CAS number of 7-Diethylamino-3,3'-carbonylbiscoumarine is 83179-57-1.
What is the molecular formula of 7-Diethylamino-3,3'-carbonylbiscoumarine?
The molecular formula of 7-Diethylamino-3,3'-carbonylbiscoumarine is C23H19NO5.
What is the molecular weight of 7-Diethylamino-3,3'-carbonylbiscoumarine?
The molecular weight of 7-Diethylamino-3,3'-carbonylbiscoumarine is 389.13 g/mol.
Where can I buy 7-Diethylamino-3,3'-carbonylbiscoumarine?
You can request a quote for 7-Diethylamino-3,3'-carbonylbiscoumarine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Diethylamino-3,3'-carbonylbiscoumarine?
Yes, KEHONG BIO provides custom synthesis services for 7-Diethylamino-3,3'-carbonylbiscoumarine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.