Benzeneethanamine, N-benzoyl-
TL;DR: Benzeneethanamine, N-benzoyl- (CAS 91068-86-9) is a chemical compound with molecular formula C16H17NO and molecular weight 239.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-(2-phenylethylamino)ethanone
Also Known As: Benzeneethanamine, N-benzoyl-, 2-(phenethylamino)-1-phenylethanone, 1-Phenyl-2-[(2-phenylethyl)amino]ethanone, 1-phenyl-2-(2-phenylethylamino)ethanone, 1-phenyl-2-[(2-phenylethyl)amino]ethan-1-one
| Molecular Formula | C16H17NO |
|---|---|
| Molecular Weight | 239.13 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 239.13101 |
| Heavy Atoms | 18 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 91068-86-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNCC(=O)C2=CC=CC=C2 |
| InChIKey | ZKCZNXNVGIPWBN-UHFFFAOYSA-N |
Product Overview
Benzeneethanamine, N-benzoyl- (CAS 91068-86-9), with molecular formula C16H17NO and molecular weight 239.13 g/mol. IUPAC: 1-phenyl-2-(2-phenylethylamino)ethanone.
Chemical Property Profile of Benzeneethanamine, N-benzoyl-
Property Insights of Benzeneethanamine, N-benzoyl-
The XLogP value of 3.2 indicates that Benzeneethanamine, N-benzoyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, Benzeneethanamine, N-benzoyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneethanamine, N-benzoyl- 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 Benzeneethanamine, N-benzoyl-?
The CAS number of Benzeneethanamine, N-benzoyl- is 91068-86-9.
What is the molecular formula of Benzeneethanamine, N-benzoyl-?
The molecular formula of Benzeneethanamine, N-benzoyl- is C16H17NO.
What is the molecular weight of Benzeneethanamine, N-benzoyl-?
The molecular weight of Benzeneethanamine, N-benzoyl- is 239.13 g/mol.
Where can I buy Benzeneethanamine, N-benzoyl-?
You can request a quote for Benzeneethanamine, N-benzoyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneethanamine, N-benzoyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneethanamine, N-benzoyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.