N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide (CAS 349537-06-0) 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-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide, AB00112466-01, N-(2H-benzo[3,4-d]1,3-dioxolen-5-ylmethyl)-2-(4-bromophenyl)acetamide, N-[(2H-1,3-BENZODIOXOL-5-YL)METHYL]-2-(4-BROMOPHENYL)ACETAMIDE
| Molecular Formula | C16H14BrNO3 |
|---|---|
| Molecular Weight | 347.02 g/mol |
| LogP | 3.0367 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.01572 |
| Heavy Atoms | 21 |
| Complexity | 655.0717 |
Chemical Identifiers
| CAS Number | 349537-06-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3=CC=C(C=C3)Br |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide (CAS 349537-06-0), with molecular formula C16H14BrNO3 and molecular weight 347.02 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide
The XLogP value of 3.0367 indicates that N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide 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-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide 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-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide is 349537-06-0.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide is C16H14BrNO3.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide is 347.02 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.