6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium
TL;DR: 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium (CAS 40478-19-1) is a chemical compound with molecular formula C14H21N2O3+ and molecular weight 265.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-ethyl-6-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-1-ium-3-carboxylate
Also Known As: 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium, 4H-Pyrido(1,2-a)pyrimidinium, 6,7,8,9-tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-, 3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-6,7,8,9-tetrahydro-4h-pyrido[1,2-a]pyrimidin-1-ium, ethyl 1-ethyl-6-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-1-ium-3-carboxylate, 4H-Pyrido pyrimidinium,6,7,8,9-tetrahydro-3- -1-ethyl-6-methyl-4-oxo-
| Molecular Formula | C14H21N2O3+ |
|---|---|
| Molecular Weight | 265.16 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 49.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.1552 |
| Heavy Atoms | 19 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 40478-19-1 |
|---|---|
| SMILES | CC[N+]1=C2CCCC(N2C(=O)C(=C1)C(=O)OCC)C |
| InChIKey | XERKRRZOBJYDNG-UHFFFAOYSA-N |
Product Overview
6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium (CAS 40478-19-1), with molecular formula C14H21N2O3+ and molecular weight 265.16 g/mol. IUPAC: ethyl 1-ethyl-6-methyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-1-ium-3-carboxylate.
Chemical Property Profile of 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium
Property Insights of 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium. With a topological polar surface area (TPSA) of 49.6 Ų, 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium has 0 hydrogen bond donor(s) and 3 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 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium?
The CAS number of 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium is 40478-19-1.
What is the molecular formula of 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium?
The molecular formula of 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium is C14H21N2O3+.
What is the molecular weight of 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium?
The molecular weight of 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium is 265.16 g/mol.
Where can I buy 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium?
You can request a quote for 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium?
Yes, KEHONG BIO provides custom synthesis services for 6,7,8,9-Tetrahydro-3-(ethoxycarbonyl)-1-ethyl-6-methyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.