N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide
TL;DR: N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide (CAS 218456-50-9) is a chemical compound with molecular formula C12H14ClFN2O2 and molecular weight 272.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide
Also Known As: Maybridge1_000983, N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide, N-(tert-butyl)-N'-(2-chloro-6-fluorobenzoyl)urea, 2-chloro-n-[[(1,1-dimethylethyl)amino]carbonyl]-6-fluoro-benzamide, Benzamide, 2-chloro-N-[[(1,1-dimethylethyl)amino]carbonyl]-6-fluoro-
| Molecular Formula | C12H14ClFN2O2 |
|---|---|
| Molecular Weight | 272.07 g/mol |
| LogP | 2.717 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.07278 |
| Heavy Atoms | 18 |
| Complexity | 463.20602 |
Chemical Identifiers
| CAS Number | 218456-50-9 |
|---|---|
| SMILES | CC(C)(C)NC(=O)NC(=O)C1=C(C=CC=C1Cl)F |
Product Overview
N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide (CAS 218456-50-9), with molecular formula C12H14ClFN2O2 and molecular weight 272.07 g/mol. IUPAC: N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide.
Chemical Property Profile of N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide
Property Insights of N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide
The XLogP value of 2.717 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide. With a topological polar surface area (TPSA) of 58.2 Ų, N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide has 2 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-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide?
The CAS number of N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide is 218456-50-9.
What is the molecular formula of N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide?
The molecular formula of N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide is C12H14ClFN2O2.
What is the molecular weight of N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide?
The molecular weight of N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide is 272.07 g/mol.
Where can I buy N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide?
You can request a quote for N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(tert-butylcarbamoyl)-2-chloro-6-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.