3-bromo-N-(2-thiophen-2-ylethyl)benzamide
TL;DR: 3-bromo-N-(2-thiophen-2-ylethyl)benzamide (CAS 727673-61-2) is a chemical compound with molecular formula C13H12BrNOS and molecular weight 308.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-(2-thiophen-2-ylethyl)benzamide
Also Known As: 3-bromo-N-(2-thiophen-2-ylethyl)benzamide, BAS 14051014, 3-bromo-N-[2-(2-thienyl)ethyl]benzamide, 3-bromo-N-[2-(thiophen-2-yl)ethyl]benzamide, 3-Bromo-N-(2-thiophen-2-yl-ethyl)-benzamide
| Molecular Formula | C13H12BrNOS |
|---|---|
| Molecular Weight | 308.98 g/mol |
| LogP | 3.4831 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.9823 |
| Heavy Atoms | 17 |
| Complexity | 495.8804 |
Chemical Identifiers
| CAS Number | 727673-61-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C(=O)NCCC2=CC=CS2 |
Product Overview
3-bromo-N-(2-thiophen-2-ylethyl)benzamide (CAS 727673-61-2), with molecular formula C13H12BrNOS and molecular weight 308.98 g/mol. IUPAC: 3-bromo-N-(2-thiophen-2-ylethyl)benzamide.
Chemical Property Profile of 3-bromo-N-(2-thiophen-2-ylethyl)benzamide
Property Insights of 3-bromo-N-(2-thiophen-2-ylethyl)benzamide
The XLogP value of 3.4831 indicates that 3-bromo-N-(2-thiophen-2-ylethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-bromo-N-(2-thiophen-2-ylethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N-(2-thiophen-2-ylethyl)benzamide has 1 hydrogen bond donor(s) and 2 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 3-bromo-N-(2-thiophen-2-ylethyl)benzamide?
The CAS number of 3-bromo-N-(2-thiophen-2-ylethyl)benzamide is 727673-61-2.
What is the molecular formula of 3-bromo-N-(2-thiophen-2-ylethyl)benzamide?
The molecular formula of 3-bromo-N-(2-thiophen-2-ylethyl)benzamide is C13H12BrNOS.
What is the molecular weight of 3-bromo-N-(2-thiophen-2-ylethyl)benzamide?
The molecular weight of 3-bromo-N-(2-thiophen-2-ylethyl)benzamide is 308.98 g/mol.
Where can I buy 3-bromo-N-(2-thiophen-2-ylethyl)benzamide?
You can request a quote for 3-bromo-N-(2-thiophen-2-ylethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N-(2-thiophen-2-ylethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-(2-thiophen-2-ylethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.