![N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide structure](/static/products/895/895939-67-0.png)
N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide
TL;DR: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide (CAS 895939-67-0) is a chemical compound with molecular formula C16H14BrNO3 and molecular weight 347.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide
Also Known As: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide, N-[1-(2H-13-BENZODIOXOL-5-YL)ETHYL]-2-BROMOBENZAMIDE, N-(2H-benzo[d]1,3-dioxolan-5-ylethyl)(2-bromophenyl)carboxamide
| Molecular Formula | C16H14BrNO3 |
|---|---|
| Molecular Weight | 347.02 g/mol |
| LogP | 3.6688 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.01572 |
| Heavy Atoms | 21 |
| Complexity | 686.97235 |
Chemical Identifiers
| CAS Number | 895939-67-0 |
|---|---|
| SMILES | CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=CC=CC=C3Br |
Product Overview
N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide (CAS 895939-67-0), with molecular formula C16H14BrNO3 and molecular weight 347.02 g/mol. IUPAC: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide.
Chemical Property Profile of N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide
Property Insights of N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide
The XLogP value of 3.6688 indicates that N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide 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 N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide?
The CAS number of N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide is 895939-67-0.
What is the molecular formula of N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide?
The molecular formula of N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide is C16H14BrNO3.
What is the molecular weight of N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide?
The molecular weight of N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide is 347.02 g/mol.
Where can I buy N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide?
You can request a quote for N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-bromobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.