Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate
TL;DR: Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate (CAS 104692-85-5) is a chemical compound with molecular formula C20H20N2O4 and molecular weight 352.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 15,16-diazatetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15,16-dicarboxylate
Also Known As: diethyl [?]dicarboxylate, Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate, Anthracene-9,10-biimine-11,12-dicarboxylic acid, 9,10-dihydro-, diethyl ester, ANTHRACENE-9,10-BIIMINE-11,12-DICARBOXYLIC ACID, 9,10-DIHYDRO-, 11,12-DIETHYL ESTER, Diethyl 9,10-dihydro-9,10-epidiazanoanthracene-11,12-dicarboxylate
| Molecular Formula | C20H20N2O4 |
|---|---|
| Molecular Weight | 352.14 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.1423 |
| Heavy Atoms | 26 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 104692-85-5 |
|---|---|
| SMILES | CCOC(=O)N1C2C3=CC=CC=C3C(N1C(=O)OCC)C4=CC=CC=C24 |
| InChIKey | VJHCBURXSKGWJA-UHFFFAOYSA-N |
Product Overview
Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate (CAS 104692-85-5), with molecular formula C20H20N2O4 and molecular weight 352.14 g/mol. IUPAC: diethyl 15,16-diazatetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15,16-dicarboxylate.
Chemical Property Profile of Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate
Property Insights of Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate
The XLogP value of 3.5 indicates that Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.1 Ų, Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate has 0 hydrogen bond donor(s) and 4 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 Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate?
The CAS number of Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate is 104692-85-5.
What is the molecular formula of Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate?
The molecular formula of Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate is C20H20N2O4.
What is the molecular weight of Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate?
The molecular weight of Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate is 352.14 g/mol.
Where can I buy Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate?
You can request a quote for Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 9,10-dihydro-9,10-diazanoanthracene-11,12-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.