![3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide structure](/static/products/3139/313953-33-2.webp)
3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide
TL;DR: 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide (CAS 313953-33-2) is a chemical compound with molecular formula C22H14BrNO3 and molecular weight 419.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide
Also Known As: 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide, 3-bromo-N-[4-(2-oxo-2H-chromen-3-yl)phenyl]benzamide
| Molecular Formula | C22H14BrNO3 |
|---|---|
| Molecular Weight | 419.02 g/mol |
| LogP | 5.4748 |
| Topological Polar Surface Area | 59.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.01572 |
| Heavy Atoms | 27 |
| Complexity | 1196.0695 |
Chemical Identifiers
| CAS Number | 313953-33-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Br |
Product Overview
3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide (CAS 313953-33-2), with molecular formula C22H14BrNO3 and molecular weight 419.02 g/mol. IUPAC: 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide.
Chemical Property Profile of 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide
Property Insights of 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide
The XLogP value of 5.4748 indicates that 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.31 Ų, 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide?
The CAS number of 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide is 313953-33-2.
What is the molecular formula of 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide?
The molecular formula of 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide is C22H14BrNO3.
What is the molecular weight of 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide?
The molecular weight of 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide is 419.02 g/mol.
Where can I buy 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide?
You can request a quote for 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]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-[4-(2-oxochromen-3-yl)phenyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-[4-(2-oxochromen-3-yl)phenyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.