N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide
TL;DR: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide (CAS 649701-21-3) is a chemical compound with molecular formula C6H6BrClN2O2 and molecular weight 251.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide
Also Known As: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide, N1-(4-bromo-3-methylisoxazol-5-yl)-2-chloroacetamide, Acetamide, N-(4-bromo-3-methyl-5-isoxazolyl)-2-chloro-, N-(4-Bromo-3-methyl-5-isoxazolyl)-2-chloroacetamide
| Molecular Formula | C6H6BrClN2O2 |
|---|---|
| Molecular Weight | 251.93 g/mol |
| LogP | 1.92282 |
| Topological Polar Surface Area | 55.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.93011 |
| Heavy Atoms | 12 |
| Complexity | 299.73822 |
Chemical Identifiers
| CAS Number | 649701-21-3 |
|---|---|
| SMILES | CC1=NOC(=C1Br)NC(=O)CCl |
Product Overview
N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide (CAS 649701-21-3), with molecular formula C6H6BrClN2O2 and molecular weight 251.93 g/mol. IUPAC: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide.
Chemical Property Profile of N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide
Property Insights of N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide
The XLogP value of 1.92282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide. With a topological polar surface area (TPSA) of 55.13 Ų, N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide 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 N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide?
The CAS number of N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide is 649701-21-3.
What is the molecular formula of N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide?
The molecular formula of N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide is C6H6BrClN2O2.
What is the molecular weight of N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide?
The molecular weight of N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide is 251.93 g/mol.
Where can I buy N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide?
You can request a quote for N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-chloroacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.