![[2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate structure](/static/products/1005/1005085-58-4.webp)
[2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate
TL;DR: [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate (CAS 1005085-58-4) is a chemical compound with molecular formula C18H21Br2NO3 and molecular weight 456.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,6-dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate
Also Known As: [2-(2,6-dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate, (2,6-dibromo-4-methyl-phenyl)carbamoylmethyl 2-(6-bicyclo[2.2.1]heptyl)acetate, [2-(2,6-dibromo-4-methylanilino)-2-oxoethyl] 2-(3-bicyclo[2.2.1]heptanyl)acetate
| Molecular Formula | C18H21Br2NO3 |
|---|---|
| Molecular Weight | 456.99 g/mol |
| LogP | 4.82802 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 456.98883 |
| Heavy Atoms | 24 |
| Complexity | 638.6591 |
Chemical Identifiers
| CAS Number | 1005085-58-4 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)Br)NC(=O)COC(=O)CC2CC3CCC2C3)Br |
Product Overview
[2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate (CAS 1005085-58-4), with molecular formula C18H21Br2NO3 and molecular weight 456.99 g/mol. IUPAC: [2-(2,6-dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate.
Chemical Property Profile of [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate
Property Insights of [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate
The XLogP value of 4.82802 indicates that [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate has 1 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 [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate?
The CAS number of [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate is 1005085-58-4.
What is the molecular formula of [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate?
The molecular formula of [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate is C18H21Br2NO3.
What is the molecular weight of [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate?
The molecular weight of [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate is 456.99 g/mol.
Where can I buy [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate?
You can request a quote for [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for [2-(2,6-Dibromo-4-methylanilino)-2-oxoethyl] 2-(2-bicyclo[2.2.1]heptanyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.