Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate
TL;DR: Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate (CAS 66709-33-9) is a chemical compound with molecular formula C18H20N2O7 and molecular weight 376.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 8-oxo-12,14-dioxa-2,7-diazatetracyclo[7.7.0.03,7.011,15]hexadeca-1(16),9,11(15)-triene-6,6-dicarboxylate
Also Known As: Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate, Diethyl 8-oxo-12,14-dioxa-2,7-diazatetracyclo[7.7.0.03,7.011,15]hexadeca-1(16),9,11(15)-triene-6,6-dicarboxylate
| Molecular Formula | C18H20N2O7 |
|---|---|
| Molecular Weight | 376.13 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 376.12704 |
| Heavy Atoms | 27 |
| Complexity | 621.0 |
Chemical Identifiers
| CAS Number | 66709-33-9 |
|---|---|
| SMILES | CCOC(=O)C1(CCC2N1C(=O)C3=CC4=C(C=C3N2)OCO4)C(=O)OCC |
| InChIKey | LCPPBXJLBNNWBD-UHFFFAOYSA-N |
Product Overview
Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate (CAS 66709-33-9), with molecular formula C18H20N2O7 and molecular weight 376.13 g/mol. IUPAC: diethyl 8-oxo-12,14-dioxa-2,7-diazatetracyclo[7.7.0.03,7.011,15]hexadeca-1(16),9,11(15)-triene-6,6-dicarboxylate.
Chemical Property Profile of Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate
Property Insights of Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate. Following Lipinski's Rule of Five, Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate has 1 hydrogen bond donor(s) and 8 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 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate?
The CAS number of Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate is 66709-33-9.
What is the molecular formula of Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate?
The molecular formula of Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate is C18H20N2O7.
What is the molecular weight of Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate?
The molecular weight of Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate is 376.13 g/mol.
Where can I buy Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate?
You can request a quote for Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 10-oxo-5,6,7,10-tetrahydro-2H-[1,3]dioxolo[4,5-g]pyrrolo[2,1-b]quinazoline-8,8(5aH)-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.