T-Butyl 5-bromo-2-chlorobenzamide
TL;DR: T-Butyl 5-bromo-2-chlorobenzamide (CAS 892018-58-5) is a chemical compound with molecular formula C11H13BrClNO and molecular weight 288.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-tert-butyl-2-chlorobenzamide
Also Known As: T-BUTYL 5-BROMO-2-CHLOROBENZAMIDE, 5-Bromo-N-(tert-butyl)-2-chlorobenzamide, 5-bromo-N-tert-butyl-2-chlorobenzamide, tert-butyl 5-bromo-2-chlorobenzamide, 5-Bromo-N-t-butyl-2-chlorobenzamide
| Molecular Formula | C11H13BrClNO |
|---|---|
| Molecular Weight | 288.99 g/mol |
| LogP | 3.6308 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.9869 |
| Heavy Atoms | 15 |
| Complexity | 384.66458 |
Chemical Identifiers
| CAS Number | 892018-58-5 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1=C(C=CC(=C1)Br)Cl |
Product Overview
T-Butyl 5-bromo-2-chlorobenzamide (CAS 892018-58-5), with molecular formula C11H13BrClNO and molecular weight 288.99 g/mol. IUPAC: 5-bromo-N-tert-butyl-2-chlorobenzamide.
Chemical Property Profile of T-Butyl 5-bromo-2-chlorobenzamide
Property Insights of T-Butyl 5-bromo-2-chlorobenzamide
The XLogP value of 3.6308 indicates that T-Butyl 5-bromo-2-chlorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, T-Butyl 5-bromo-2-chlorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, T-Butyl 5-bromo-2-chlorobenzamide 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 T-Butyl 5-bromo-2-chlorobenzamide?
The CAS number of T-Butyl 5-bromo-2-chlorobenzamide is 892018-58-5.
What is the molecular formula of T-Butyl 5-bromo-2-chlorobenzamide?
The molecular formula of T-Butyl 5-bromo-2-chlorobenzamide is C11H13BrClNO.
What is the molecular weight of T-Butyl 5-bromo-2-chlorobenzamide?
The molecular weight of T-Butyl 5-bromo-2-chlorobenzamide is 288.99 g/mol.
Where can I buy T-Butyl 5-bromo-2-chlorobenzamide?
You can request a quote for T-Butyl 5-bromo-2-chlorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for T-Butyl 5-bromo-2-chlorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for T-Butyl 5-bromo-2-chlorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.