![Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate structure](/static/products/6315/6315-55-5.webp)
Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate
TL;DR: Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate (CAS 6315-55-5) is a chemical compound with molecular formula C18H24BrNO7 and molecular weight 445.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-acetamido-2-[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate
Also Known As: diethyl(acetylamino)(2-bromo-3,4-dimethoxybenzyl)propanedioate, Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate, diethyl 2-acetamido-2-[(2-bromo-3,4-dimethoxy-phenyl)methyl]propanedioate, diethyl 2-acetamido-2-[(2-bromo-3,4-dimethoxyphenyl)methyl]p, diethyl 2-acetamido-2-[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate
| Molecular Formula | C18H24BrNO7 |
|---|---|
| Molecular Weight | 445.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 445.0736 |
| Heavy Atoms | 27 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 6315-55-5 |
|---|---|
| SMILES | CCOC(=O)C(CC1=C(C(=C(C=C1)OC)OC)Br)(C(=O)OCC)NC(=O)C |
| InChIKey | ALUUJOBUGSMFQC-UHFFFAOYSA-N |
Product Overview
Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate (CAS 6315-55-5), with molecular formula C18H24BrNO7 and molecular weight 445.07 g/mol. IUPAC: diethyl 2-acetamido-2-[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate.
Chemical Property Profile of Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate
Property Insights of Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate. Following Lipinski's Rule of Five, Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate has 1 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 Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate?
The CAS number of Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate is 6315-55-5.
What is the molecular formula of Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate?
The molecular formula of Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate is C18H24BrNO7.
What is the molecular weight of Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate?
The molecular weight of Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate is 445.07 g/mol.
Where can I buy Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate?
You can request a quote for Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl acetamido[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.