N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
TL;DR: N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide (CAS 1042780-00-6) is a chemical compound with molecular formula C12H13BrN2O3S and molecular weight 343.98303 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
Also Known As: N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide, N-(4-Bromo-2-methylphenyl)-3,5-dimethyl-4-isoxazolesulfonamide
Technical Specifications
| Molecular Formula | C12H13BrN2O3S |
| Molecular Weight | 343.98303 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 80.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.98303 Da |
| Heavy Atoms | 19 |
| Complexity | 412.0 |
| SMILES | CC1=C(C=CC(=C1)Br)NS(=O)(=O)C2=C(ON=C2C)C |
| InChIKey | BFXGBBUYCFIZCO-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
Property Insights of N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide. Following Lipinski's Rule of Five, N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
The CAS number of N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide is 1042780-00-6.
What is the molecular formula of N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
The molecular formula of N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide is C12H13BrN2O3S.
What is the molecular weight of N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
The molecular weight of N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide is 343.98303 g/mol.
Where can I buy N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
You can request a quote for N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
Yes, CoreyChem provides custom synthesis services for N-(4-bromo-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.