N-(Isoxazol-3-yl)-2-phenylbutanamide
TL;DR: N-(Isoxazol-3-yl)-2-phenylbutanamide (CAS 774588-62-4) is a chemical compound with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,2-oxazol-3-yl)-2-phenylbutanamide
Also Known As: N-(Isoxazol-3-yl)-2-phenylbutanamide, N-3-isoxazolyl-2-phenylbutanamide, N-(1,2-oxazol-3-yl)-2-phenylbutanamide, N-isoxazol-3-yl-2-phenylbutanamide, N-(12-OXAZOL-3-YL)-2-PHENYLBUTANAMIDE
| Molecular Formula | C13H14N2O2 |
|---|---|
| Molecular Weight | 230.11 g/mol |
| LogP | 2.8069 |
| Topological Polar Surface Area | 55.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.10553 |
| Heavy Atoms | 17 |
| Complexity | 465.42938 |
Chemical Identifiers
| CAS Number | 774588-62-4 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)C(=O)NC2=NOC=C2 |
Product Overview
N-(Isoxazol-3-yl)-2-phenylbutanamide (CAS 774588-62-4), with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol. IUPAC: N-(1,2-oxazol-3-yl)-2-phenylbutanamide.
Chemical Property Profile of N-(Isoxazol-3-yl)-2-phenylbutanamide
Property Insights of N-(Isoxazol-3-yl)-2-phenylbutanamide
The XLogP value of 2.8069 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(Isoxazol-3-yl)-2-phenylbutanamide. With a topological polar surface area (TPSA) of 55.13 Ų, N-(Isoxazol-3-yl)-2-phenylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(Isoxazol-3-yl)-2-phenylbutanamide 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-(Isoxazol-3-yl)-2-phenylbutanamide?
The CAS number of N-(Isoxazol-3-yl)-2-phenylbutanamide is 774588-62-4.
What is the molecular formula of N-(Isoxazol-3-yl)-2-phenylbutanamide?
The molecular formula of N-(Isoxazol-3-yl)-2-phenylbutanamide is C13H14N2O2.
What is the molecular weight of N-(Isoxazol-3-yl)-2-phenylbutanamide?
The molecular weight of N-(Isoxazol-3-yl)-2-phenylbutanamide is 230.11 g/mol.
Where can I buy N-(Isoxazol-3-yl)-2-phenylbutanamide?
You can request a quote for N-(Isoxazol-3-yl)-2-phenylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Isoxazol-3-yl)-2-phenylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(Isoxazol-3-yl)-2-phenylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.