2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide
TL;DR: 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide (CAS 97872-14-5) is a chemical compound with molecular formula C19H20N2O2 and molecular weight 308.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,2-benzoxazol-3-yl)-N-(2-phenylbutan-2-yl)acetamide
Also Known As: 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide, 2-(1,2-benzoxazol-3-yl)-N-(2-phenylbutan-2-yl)acetamide, 2-benzo[d]isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide, (1,2-Benzoxazol-3-yl)-N-(2-phenylbutan-2-yl)ethanimidic acid, 2-(1,2-Benzoxazol-3-yl)-N-(2-phenylbutan-2-yl)ethanimidic acid
| Molecular Formula | C19H20N2O2 |
|---|---|
| Molecular Weight | 308.15 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.15247 |
| Heavy Atoms | 23 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 97872-14-5 |
|---|---|
| SMILES | CCC(C)(C1=CC=CC=C1)NC(=O)CC2=NOC3=CC=CC=C32 |
| InChIKey | LSPHNMMYZMCOMD-UHFFFAOYSA-N |
Product Overview
2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide (CAS 97872-14-5), with molecular formula C19H20N2O2 and molecular weight 308.15 g/mol. IUPAC: 2-(1,2-benzoxazol-3-yl)-N-(2-phenylbutan-2-yl)acetamide.
Chemical Property Profile of 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide
Property Insights of 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide
The XLogP value of 3.6 indicates that 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide 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-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide?
The CAS number of 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide is 97872-14-5.
What is the molecular formula of 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide?
The molecular formula of 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide is C19H20N2O2.
What is the molecular weight of 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide?
The molecular weight of 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide is 308.15 g/mol.
Where can I buy 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide?
You can request a quote for 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzo(d)isoxazol-3-yl-N-(2-phenylbutan-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.