Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate
TL;DR: Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate (CAS 43167-11-9) is a chemical compound with molecular formula C10H13N3O6 and molecular weight 271.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-(4,6-dioxo-1H-1,3,5-triazin-2-yl)propanedioate
Also Known As: Dicarboethoxy methyl dihydroxy triazine, diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate, diethyl 2-(4,6-dioxo-1H-1,3,5-triazin-2-yl)propanedioate, 2-(diethoxycarbonylmethyl)-4,6-dihydroxy-s-triazine, (4,6-Dihydroxy-{1,3,5}triazin-2-yl)-malonsaeurediaethylester
| Molecular Formula | C10H13N3O6 |
|---|---|
| Molecular Weight | 271.08 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 271.08044 |
| Heavy Atoms | 19 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 43167-11-9 |
|---|---|
| SMILES | CCOC(=O)C(C1=NC(=O)NC(=O)N1)C(=O)OCC |
| InChIKey | CZVURWKLVXYGOW-UHFFFAOYSA-N |
Product Overview
Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate (CAS 43167-11-9), with molecular formula C10H13N3O6 and molecular weight 271.08 g/mol. IUPAC: diethyl 2-(4,6-dioxo-1H-1,3,5-triazin-2-yl)propanedioate.
Chemical Property Profile of Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate
Property Insights of Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate. Following Lipinski's Rule of Five, Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate has 2 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(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate?
The CAS number of Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate is 43167-11-9.
What is the molecular formula of Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate?
The molecular formula of Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate is C10H13N3O6.
What is the molecular weight of Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate?
The molecular weight of Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate is 271.08 g/mol.
Where can I buy Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate?
You can request a quote for Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl(4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl)propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.