![N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide structure](/static/products/858/858767-44-9.png)
N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide
TL;DR: N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide (CAS 858767-44-9) is a chemical compound with molecular formula C18H19N3O7 and molecular weight 389.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[7-methoxy-6-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1,3-benzodioxol-5-yl]ethyl]-N-methylacetamide
Also Known As: N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide, N-(2-{6-[(Z)-(2-hydroxy-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-N-methylacetamide, N-[2-[7-methoxy-6-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1,3-benzodioxol-5-yl]ethyl]-N-methylacetamide
| Molecular Formula | C18H19N3O7 |
|---|---|
| Molecular Weight | 389.12 g/mol |
| LogP | 0.1941 |
| Topological Polar Surface Area | 123.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.1223 |
| Heavy Atoms | 28 |
| Complexity | 884.93054 |
Chemical Identifiers
| CAS Number | 858767-44-9 |
|---|---|
| SMILES | CC(=O)N(C)CCC1=CC2=C(C(=C1C=C3C(=O)NC(=O)NC3=O)OC)OCO2 |
Product Overview
N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide (CAS 858767-44-9), with molecular formula C18H19N3O7 and molecular weight 389.12 g/mol. IUPAC: N-[2-[7-methoxy-6-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1,3-benzodioxol-5-yl]ethyl]-N-methylacetamide.
Chemical Property Profile of N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide
Property Insights of N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide
The XLogP value of 0.1941 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide. The TPSA of 123.27 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide. Following Lipinski's Rule of Five, N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide has 2 hydrogen bond donor(s) and 7 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 N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide?
The CAS number of N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide is 858767-44-9.
What is the molecular formula of N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide?
The molecular formula of N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide is C18H19N3O7.
What is the molecular weight of N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide?
The molecular weight of N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide is 389.12 g/mol.
Where can I buy N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide?
You can request a quote for N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-(7-methoxy-6-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)benzo[d][1,3]dioxol-5-yl)ethyl)-N-methylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.