3-bromo-N-(thiophen-2-ylmethyl)benzamide
TL;DR: 3-bromo-N-(thiophen-2-ylmethyl)benzamide (CAS 546067-90-7) is a chemical compound with molecular formula C12H10BrNOS and molecular weight 294.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-(thiophen-2-ylmethyl)benzamide
Also Known As: 3-Bromo-N-(2-thienylmethyl)benzamide, 3-bromo-N-(thiophen-2-ylmethyl)benzamide, 3-bromo-N-[(thiophen-2-yl)methyl]benzamide, (3-bromophenyl)-N-(2-thienylmethyl)carboxamide
| Molecular Formula | C12H10BrNOS |
|---|---|
| Molecular Weight | 294.97 g/mol |
| LogP | 3.4406 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.96664 |
| Heavy Atoms | 16 |
| Complexity | 481.5238 |
Chemical Identifiers
| CAS Number | 546067-90-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C(=O)NCC2=CC=CS2 |
Product Overview
3-bromo-N-(thiophen-2-ylmethyl)benzamide (CAS 546067-90-7), with molecular formula C12H10BrNOS and molecular weight 294.97 g/mol. IUPAC: 3-bromo-N-(thiophen-2-ylmethyl)benzamide.
Chemical Property Profile of 3-bromo-N-(thiophen-2-ylmethyl)benzamide
Property Insights of 3-bromo-N-(thiophen-2-ylmethyl)benzamide
The XLogP value of 3.4406 indicates that 3-bromo-N-(thiophen-2-ylmethyl)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-(thiophen-2-ylmethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N-(thiophen-2-ylmethyl)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-(thiophen-2-ylmethyl)benzamide?
The CAS number of 3-bromo-N-(thiophen-2-ylmethyl)benzamide is 546067-90-7.
What is the molecular formula of 3-bromo-N-(thiophen-2-ylmethyl)benzamide?
The molecular formula of 3-bromo-N-(thiophen-2-ylmethyl)benzamide is C12H10BrNOS.
What is the molecular weight of 3-bromo-N-(thiophen-2-ylmethyl)benzamide?
The molecular weight of 3-bromo-N-(thiophen-2-ylmethyl)benzamide is 294.97 g/mol.
Where can I buy 3-bromo-N-(thiophen-2-ylmethyl)benzamide?
You can request a quote for 3-bromo-N-(thiophen-2-ylmethyl)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-(thiophen-2-ylmethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-(thiophen-2-ylmethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.