4-bromo-N-(pyridin-3-yl)benzamide
TL;DR: 4-bromo-N-(pyridin-3-yl)benzamide (CAS 70301-29-0) is a chemical compound with molecular formula C12H9BrN2O and molecular weight 275.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-pyridin-3-ylbenzamide
Also Known As: 4-bromo-N-(pyridin-3-yl)benzamide, 4-Bromo-N-3-pyridinylbenzamide, 4-bromo-N-pyridin-3-ylbenzamide, 4-Bromo-N-(3-pyridyl)benzamide, 4-Bromo-N-(3-pyridinyl)benzamide
| Molecular Formula | C12H9BrN2O |
|---|---|
| Molecular Weight | 275.99 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.98984 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 70301-29-0 |
|---|---|
| SMILES | C1=CC(=CN=C1)NC(=O)C2=CC=C(C=C2)Br |
| InChIKey | WBGOUSGRVAAACL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-bromo-N-(pyridin-3-yl)benzamide (CAS 70301-29-0), with molecular formula C12H9BrN2O and molecular weight 275.99 g/mol. IUPAC: 4-bromo-N-pyridin-3-ylbenzamide.
Chemical Property Profile of 4-bromo-N-(pyridin-3-yl)benzamide
Property Insights of 4-bromo-N-(pyridin-3-yl)benzamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-N-(pyridin-3-yl)benzamide. With a topological polar surface area (TPSA) of 42.0 Ų, 4-bromo-N-(pyridin-3-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-(pyridin-3-yl)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 4-bromo-N-(pyridin-3-yl)benzamide?
The CAS number of 4-bromo-N-(pyridin-3-yl)benzamide is 70301-29-0.
What is the molecular formula of 4-bromo-N-(pyridin-3-yl)benzamide?
The molecular formula of 4-bromo-N-(pyridin-3-yl)benzamide is C12H9BrN2O.
What is the molecular weight of 4-bromo-N-(pyridin-3-yl)benzamide?
The molecular weight of 4-bromo-N-(pyridin-3-yl)benzamide is 275.99 g/mol.
Where can I buy 4-bromo-N-(pyridin-3-yl)benzamide?
You can request a quote for 4-bromo-N-(pyridin-3-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-(pyridin-3-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-(pyridin-3-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.