![3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide structure](/static/products/4452/445261-06-3.webp)
3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide
TL;DR: 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide (CAS 445261-06-3) is a chemical compound with molecular formula C20H21BrN2O2 and molecular weight 400.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[(Z)-3-(diethylamino)-3-oxo-1-phenylprop-1-en-2-yl]benzamide
Also Known As: 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide, AL-281/15328090, 3-bromo-N-[(Z)-3-(diethylamino)-3-oxo-1-phenylprop-1-en-2-yl]benzamide
| Molecular Formula | C20H21BrN2O2 |
|---|---|
| Molecular Weight | 400.08 g/mol |
| LogP | 4.0884 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.07864 |
| Heavy Atoms | 25 |
| Complexity | 768.27545 |
Chemical Identifiers
| CAS Number | 445261-06-3 |
|---|---|
| SMILES | CCN(CC)C(=O)/C(=C/C1=CC=CC=C1)/NC(=O)C2=CC(=CC=C2)Br |
Product Overview
3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide (CAS 445261-06-3), with molecular formula C20H21BrN2O2 and molecular weight 400.08 g/mol. IUPAC: 3-bromo-N-[(Z)-3-(diethylamino)-3-oxo-1-phenylprop-1-en-2-yl]benzamide.
Chemical Property Profile of 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide
Property Insights of 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide
The XLogP value of 4.0884 indicates that 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}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-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide?
The CAS number of 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide is 445261-06-3.
What is the molecular formula of 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide?
The molecular formula of 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide is C20H21BrN2O2.
What is the molecular weight of 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide?
The molecular weight of 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide is 400.08 g/mol.
Where can I buy 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide?
You can request a quote for 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}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-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-{1-[(diethylamino)carbonyl]-2-phenylvinyl}benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.