3-Bromo-N-isobutylbenzamide
TL;DR: 3-Bromo-N-isobutylbenzamide (CAS 333345-92-9) is a chemical compound with molecular formula C11H14BrNO and molecular weight 255.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-(2-methylpropyl)benzamide
Also Known As: 3-Bromo-N-isobutylbenzamide, 3-bromo-N-(2-methylpropyl)benzamide, 3-Bromo-N-isobutyl-benzamide, Benzamide, 3-bromo-N-isobutyl-, BAS 00783025
| Molecular Formula | C11H14BrNO |
|---|---|
| Molecular Weight | 255.03 g/mol |
| LogP | 2.8349 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.02588 |
| Heavy Atoms | 14 |
| Complexity | 322.8185 |
Chemical Identifiers
| CAS Number | 333345-92-9 |
|---|---|
| SMILES | CC(C)CNC(=O)C1=CC(=CC=C1)Br |
Product Overview
3-Bromo-N-isobutylbenzamide (CAS 333345-92-9), with molecular formula C11H14BrNO and molecular weight 255.03 g/mol. IUPAC: 3-bromo-N-(2-methylpropyl)benzamide.
Chemical Property Profile of 3-Bromo-N-isobutylbenzamide
Property Insights of 3-Bromo-N-isobutylbenzamide
The XLogP value of 2.8349 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromo-N-isobutylbenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, 3-Bromo-N-isobutylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-N-isobutylbenzamide has 1 hydrogen bond donor(s) and 1 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-isobutylbenzamide?
The CAS number of 3-Bromo-N-isobutylbenzamide is 333345-92-9.
What is the molecular formula of 3-Bromo-N-isobutylbenzamide?
The molecular formula of 3-Bromo-N-isobutylbenzamide is C11H14BrNO.
What is the molecular weight of 3-Bromo-N-isobutylbenzamide?
The molecular weight of 3-Bromo-N-isobutylbenzamide is 255.03 g/mol.
Where can I buy 3-Bromo-N-isobutylbenzamide?
You can request a quote for 3-Bromo-N-isobutylbenzamide 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-isobutylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-N-isobutylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.