N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide
TL;DR: N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide (CAS 314030-00-7) is a chemical compound with molecular formula C16H17BrN2O and molecular weight 332.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-bromo-2-pyridinyl)-4-tert-butylbenzamide
Also Known As: N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide, BIM-0037532.P001, N-(5-Bromo-2-pyridinyl)-4-(1,1-dimethylethyl)benzamide, N-(5-bromo-2-pyridinyl)-4-tert-butylbenzamide, [4-(tert-butyl)phenyl]-N-(5-bromo(2-pyridyl))carboxamide
| Molecular Formula | C16H17BrN2O |
|---|---|
| Molecular Weight | 332.05 g/mol |
| LogP | 4.3939 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.05243 |
| Heavy Atoms | 20 |
| Complexity | 597.86914 |
Chemical Identifiers
| CAS Number | 314030-00-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NC=C(C=C2)Br |
Product Overview
N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide (CAS 314030-00-7), with molecular formula C16H17BrN2O and molecular weight 332.05 g/mol. IUPAC: N-(5-bromo-2-pyridinyl)-4-tert-butylbenzamide.
Chemical Property Profile of N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide
Property Insights of N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide
The XLogP value of 4.3939 indicates that N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide 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 N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide?
The CAS number of N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide is 314030-00-7.
What is the molecular formula of N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide?
The molecular formula of N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide is C16H17BrN2O.
What is the molecular weight of N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide?
The molecular weight of N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide is 332.05 g/mol.
Where can I buy N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide?
You can request a quote for N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-bromopyridin-2-yl)-4-tert-butylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.