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Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate
TL;DR: Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate (CAS 71239-46-8) is a chemical compound with molecular formula C17H17N3O4 and molecular weight 327.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate
Also Known As: diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate, Diethyl 1-aminopyrido[1,2-a][1,3]benzimidazole-2,4-dicarboxylate
| Molecular Formula | C17H17N3O4 |
|---|---|
| Molecular Weight | 327.12 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 95.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 327.12192 |
| Heavy Atoms | 24 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 71239-46-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=C(N2C1=NC3=CC=CC=C32)N)C(=O)OCC |
| InChIKey | CHFATKZUSLWUIE-UHFFFAOYSA-N |
Product Overview
Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate (CAS 71239-46-8), with molecular formula C17H17N3O4 and molecular weight 327.12 g/mol. IUPAC: diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate.
Chemical Property Profile of Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate
Property Insights of Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate
The XLogP value of 3.8 indicates that Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate. Following Lipinski's Rule of Five, Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate 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 Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate?
The CAS number of Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate is 71239-46-8.
What is the molecular formula of Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate?
The molecular formula of Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate is C17H17N3O4.
What is the molecular weight of Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate?
The molecular weight of Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate is 327.12 g/mol.
Where can I buy Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate?
You can request a quote for Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 1-aminopyrido[1,2-a]benzimidazole-2,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.