2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide
TL;DR: 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide (CAS 333446-77-8) is a chemical compound with molecular formula C13H19BrN2O3S and molecular weight 362.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide
Also Known As: BAS 02178245, 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide, 2-[3-bromo(methylsulfonyl)anilino]-N-(tert-butyl)acetamide, 2-[(3-Bromo-phenyl)-methanesulfonyl-amino]-N-tert-butyl-acetamide
| Molecular Formula | C13H19BrN2O3S |
|---|---|
| Molecular Weight | 362.03 g/mol |
| LogP | 2.1298 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.02997 |
| Heavy Atoms | 20 |
| Complexity | 593.87897 |
Chemical Identifiers
| CAS Number | 333446-77-8 |
|---|---|
| SMILES | CC(C)(C)NC(=O)CN(C1=CC(=CC=C1)Br)S(=O)(=O)C |
Product Overview
2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide (CAS 333446-77-8), with molecular formula C13H19BrN2O3S and molecular weight 362.03 g/mol. IUPAC: 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide.
Chemical Property Profile of 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide
Property Insights of 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide
The XLogP value of 2.1298 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide. Following Lipinski's Rule of Five, 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide has 1 hydrogen bond donor(s) and 3 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 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide?
The CAS number of 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide is 333446-77-8.
What is the molecular formula of 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide?
The molecular formula of 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide is C13H19BrN2O3S.
What is the molecular weight of 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide?
The molecular weight of 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide is 362.03 g/mol.
Where can I buy 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide?
You can request a quote for 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-bromo-N-methylsulfonylanilino)-N-tert-butylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.