N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide
TL;DR: N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide (CAS 1164486-81-0) is a chemical compound with molecular formula C13H12N2O2 and molecular weight 228.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-(5-methyl-1,2-oxazol-3-yl)-3-phenylprop-2-enamide
Also Known As: N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide, N-(5-methylisoxazol-3-yl)cinnamamide, (E)-N-(5-methyl-1,2-oxazol-3-yl)-3-phenylprop-2-enamide, (2E)-N-(5-methylisoxazol-3-yl)-3-phenylprop-2-enamide, (2E)-N-(5-methyl-1,2-oxazol-3-yl)-3-phenylprop-2-enamide
Technical Specifications
| Molecular Formula | C13H12N2O2 |
| Molecular Weight | 228.08987 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.08987 Da |
| Heavy Atoms | 17 |
| Complexity | 285.0 |
| SMILES | CC1=CC(=NO1)NC(=O)/C=C/C2=CC=CC=C2 |
| InChIKey | HKHMRZZOMKKLQF-BQYQJAHWSA-N |
Chemical Property Profile of N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide
Property Insights of N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide. With a topological polar surface area (TPSA) of 55.1 Ų, N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide 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
What is the CAS number of N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide?
The CAS number of N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide is 1164486-81-0.
What is the molecular formula of N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide?
The molecular formula of N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide is C13H12N2O2.
What is the molecular weight of N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide?
The molecular weight of N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide is 228.08987 g/mol.
Where can I buy N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide?
You can request a quote for N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide?
Yes, CoreyChem provides custom synthesis services for N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.