N-(4-溴苯基)-4-氧代-4-苯基丁酰胺
TL;DR: N-(4-溴苯基)-4-氧代-4-苯基丁酰胺 (CAS 6621-86-9) is a chemical compound with molecular formula C16H14BrNO2 and molecular weight 331.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-溴苯基)-4-氧代-4-苯基丁酰胺
N-(4-bromophenyl)-4-oxo-4-phenylbutanamide
Also Known As: n-(4-bromophenyl)-4-oxo-4-phenylbutanamide, N-(4-bromophenyl)-4-oxo-4-phenyl-butanamide, N-Butyl-N-(2-(trifluoromethyl)-9H-purin-6-yl)amine
| Molecular Formula | C16H14BrNO2 |
|---|---|
| Molecular Weight | 331.02 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.02078 |
| Heavy Atoms | 20 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 6621-86-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CCC(=O)NC2=CC=C(C=C2)Br |
| InChIKey | BBTAKZUVOXLJEB-UHFFFAOYSA-N |
Product Overview
N-(4-溴苯基)-4-氧代-4-苯基丁酰胺 (CAS 6621-86-9), with molecular formula C16H14BrNO2 and molecular weight 331.02 g/mol. IUPAC: N-(4-bromophenyl)-4-oxo-4-phenylbutanamide.
Chemical Property Profile of N-(4-溴苯基)-4-氧代-4-苯基丁酰胺
Property Insights of N-(4-溴苯基)-4-氧代-4-苯基丁酰胺
The XLogP value of 3.0 indicates that N-(4-溴苯基)-4-氧代-4-苯基丁酰胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.2 Ų, N-(4-溴苯基)-4-氧代-4-苯基丁酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-溴苯基)-4-氧代-4-苯基丁酰胺 has 1 hydrogen bond donor(s) and 2 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-(4-溴苯基)-4-氧代-4-苯基丁酰胺?
The CAS number of N-(4-溴苯基)-4-氧代-4-苯基丁酰胺 is 6621-86-9.
What is the molecular formula of N-(4-溴苯基)-4-氧代-4-苯基丁酰胺?
The molecular formula of N-(4-溴苯基)-4-氧代-4-苯基丁酰胺 is C16H14BrNO2.
What is the molecular weight of N-(4-溴苯基)-4-氧代-4-苯基丁酰胺?
The molecular weight of N-(4-溴苯基)-4-氧代-4-苯基丁酰胺 is 331.02 g/mol.
Where can I buy N-(4-溴苯基)-4-氧代-4-苯基丁酰胺?
You can request a quote for N-(4-溴苯基)-4-氧代-4-苯基丁酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-溴苯基)-4-氧代-4-苯基丁酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-(4-溴苯基)-4-氧代-4-苯基丁酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.