![N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺 structure](/static/products/1285/128550-40-3.webp)
N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺
TL;DR: N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺 (CAS 128550-40-3) is a chemical compound with molecular formula C12H12F3NO2 and molecular weight 259.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺
N-(4,4,4-trifluoro-3-oxo-1-phenylbutan-2-yl)acetamide
Also Known As: Acetamide, N-[3,3,3-trifluoro-2-oxo-1-(phenylmethyl)propyl]-, N-(4,4,4-trifluoro-3-oxo-1-phenylbutan-2-yl)acetamide, N1,N5,N10,N14-tetra-tert-butoxycarbonyl-1,5,10,14,18-pentaazaoctadecane, 1,1,1-trifluoro-3-acetamido-4-phenyl butan-2-one(n-acetyl-l-phenylalanyl trifluoromethyl ketone)
| Molecular Formula | C12H12F3NO2 |
|---|---|
| Molecular Weight | 259.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.082 |
| Heavy Atoms | 18 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 128550-40-3 |
|---|---|
| SMILES | CC(=O)NC(CC1=CC=CC=C1)C(=O)C(F)(F)F |
| InChIKey | JTIIYPHJIDENCW-UHFFFAOYSA-N |
Product Overview
N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺 (CAS 128550-40-3), with molecular formula C12H12F3NO2 and molecular weight 259.08 g/mol. IUPAC: N-(4,4,4-trifluoro-3-oxo-1-phenylbutan-2-yl)acetamide.
Chemical Property Profile of N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺
Property Insights of N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺. With a topological polar surface area (TPSA) of 46.2 Ų, N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺 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 N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺?
The CAS number of N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺 is 128550-40-3.
What is the molecular formula of N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺?
The molecular formula of N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺 is C12H12F3NO2.
What is the molecular weight of N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺?
The molecular weight of N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺 is 259.08 g/mol.
Where can I buy N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺?
You can request a quote for N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-[3,3,3-三氟-2-氧代-1-(苯甲基)丙基]乙酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.