![methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate structure](/static/products/839/839682-40-5.png)
methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate
TL;DR: methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate (CAS 839682-40-5) is a chemical compound with molecular formula C18H19N5O4 and molecular weight 369.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-methyl-6-(2-methylphenyl)-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetate
Also Known As: methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate, methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1H,2H,3H,4H,6H,7H,8H-imidazo[1,2-g]purin-3-yl]acetate, methyl 2-[4-methyl-6-(2-methylphenyl)-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetate, methyl [1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl]acetate, Methyl 2-(1-methyl-2,4-dioxo-8-(o-tolyl)-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl)acetate
| Molecular Formula | C18H19N5O4 |
|---|---|
| Molecular Weight | 369.14 g/mol |
| LogP | 0.52982 |
| Topological Polar Surface Area | 91.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 369.1437 |
| Heavy Atoms | 27 |
| Complexity | 1186.9058 |
Chemical Identifiers
| CAS Number | 839682-40-5 |
|---|---|
| SMILES | CC1=CC=CC=C1N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=O)OC |
Product Overview
methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate (CAS 839682-40-5), with molecular formula C18H19N5O4 and molecular weight 369.14 g/mol. IUPAC: methyl 2-[4-methyl-6-(2-methylphenyl)-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetate.
Chemical Property Profile of methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate
Property Insights of methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate
The XLogP value of 0.52982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate. The TPSA of 91.36 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate. Following Lipinski's Rule of Five, methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate has 0 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 methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate?
The CAS number of methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate is 839682-40-5.
What is the molecular formula of methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate?
The molecular formula of methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate is C18H19N5O4.
What is the molecular weight of methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate?
The molecular weight of methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate is 369.14 g/mol.
Where can I buy methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate?
You can request a quote for methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-[1-methyl-8-(2-methylphenyl)-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.