![2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide structure](/static/products/896/896072-49-4.png)
2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide
TL;DR: 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide (CAS 896072-49-4) is a chemical compound with molecular formula C19H19BrN2O4 and molecular weight 418.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-[[3-(2,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]benzamide
Also Known As: 2-bromo-N-[[3-(2,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]benzamide, 2-bromo-N-((3-(2,4-dimethoxyphenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzamide, 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide, 2-bromo-N-{[3-(2,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}benzamide
| Molecular Formula | C19H19BrN2O4 |
|---|---|
| Molecular Weight | 418.05 g/mol |
| LogP | 3.3893 |
| Topological Polar Surface Area | 69.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.05283 |
| Heavy Atoms | 26 |
| Complexity | 838.0389 |
Chemical Identifiers
| CAS Number | 896072-49-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C2=NOC(C2)CNC(=O)C3=CC=CC=C3Br)OC |
Product Overview
2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide (CAS 896072-49-4), with molecular formula C19H19BrN2O4 and molecular weight 418.05 g/mol. IUPAC: 2-bromo-N-[[3-(2,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]benzamide.
Chemical Property Profile of 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide
Property Insights of 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide
The XLogP value of 3.3893 indicates that 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide. Following Lipinski's Rule of Five, 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide 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
Frequently Asked Questions
What is the CAS number of 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide?
The CAS number of 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide is 896072-49-4.
What is the molecular formula of 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide?
The molecular formula of 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide is C19H19BrN2O4.
What is the molecular weight of 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide?
The molecular weight of 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide is 418.05 g/mol.
Where can I buy 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide?
You can request a quote for 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-N-[3-(2,4-dimethoxy-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.