4-bromo-N-(pyridin-2-ylmethyl)benzamide
TL;DR: 4-bromo-N-(pyridin-2-ylmethyl)benzamide (CAS 313985-45-4) is a chemical compound with molecular formula C13H11BrN2O and molecular weight 290.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-(pyridin-2-ylmethyl)benzamide
Also Known As: 4-bromo-N-(pyridin-2-ylmethyl)benzamide, 4-bromo-N-(2-pyridinylmethyl)benzamide, N-(2-Pyridinylmethyl)-4-bromobenzamide, 4-bromo-N-[(pyridin-2-yl)methyl]benzamide, J2.728.842A
| Molecular Formula | C13H11BrN2O |
|---|---|
| Molecular Weight | 290.01 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.0055 |
| Heavy Atoms | 17 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 313985-45-4 |
|---|---|
| SMILES | C1=CC=NC(=C1)CNC(=O)C2=CC=C(C=C2)Br |
| InChIKey | QFFQUGRPENSEGB-UHFFFAOYSA-N |
Product Overview
4-bromo-N-(pyridin-2-ylmethyl)benzamide (CAS 313985-45-4), with molecular formula C13H11BrN2O and molecular weight 290.01 g/mol. IUPAC: 4-bromo-N-(pyridin-2-ylmethyl)benzamide.
Chemical Property Profile of 4-bromo-N-(pyridin-2-ylmethyl)benzamide
Property Insights of 4-bromo-N-(pyridin-2-ylmethyl)benzamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-N-(pyridin-2-ylmethyl)benzamide. With a topological polar surface area (TPSA) of 42.0 Ų, 4-bromo-N-(pyridin-2-ylmethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-(pyridin-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 4-bromo-N-(pyridin-2-ylmethyl)benzamide?
The CAS number of 4-bromo-N-(pyridin-2-ylmethyl)benzamide is 313985-45-4.
What is the molecular formula of 4-bromo-N-(pyridin-2-ylmethyl)benzamide?
The molecular formula of 4-bromo-N-(pyridin-2-ylmethyl)benzamide is C13H11BrN2O.
What is the molecular weight of 4-bromo-N-(pyridin-2-ylmethyl)benzamide?
The molecular weight of 4-bromo-N-(pyridin-2-ylmethyl)benzamide is 290.01 g/mol.
Where can I buy 4-bromo-N-(pyridin-2-ylmethyl)benzamide?
You can request a quote for 4-bromo-N-(pyridin-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 4-bromo-N-(pyridin-2-ylmethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-(pyridin-2-ylmethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.