n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide
TL;DR: n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide (CAS 628711-76-2) is a chemical compound with molecular formula C16H16BrNO and molecular weight 317.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-4-methyl-N-[(1R)-1-phenylethyl]benzamide
Also Known As: n-((1r)-1-phenylethyl)(3-bromo-4-methylphenyl)carboxamide, 3-bromo-4-methyl-N-[(1R)-1-phenylethyl]benzamide, (R)-3-Bromo-4-methyl-N-(1-phenylethyl)benzamide, A1-15277
| Molecular Formula | C16H16BrNO |
|---|---|
| Molecular Weight | 317.04 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.04153 |
| Heavy Atoms | 19 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 628711-76-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)N[C@H](C)C2=CC=CC=C2)Br |
| InChIKey | OPVAAJSUIURGPJ-GFCCVEGCSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide (CAS 628711-76-2), with molecular formula C16H16BrNO and molecular weight 317.04 g/mol. IUPAC: 3-bromo-4-methyl-N-[(1R)-1-phenylethyl]benzamide.
Chemical Property Profile of n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide
Property Insights of n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide
The XLogP value of 4.2 indicates that n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide has 1 hydrogen bond donor(s) and 1 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-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide?
The CAS number of n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide is 628711-76-2.
What is the molecular formula of n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide?
The molecular formula of n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide is C16H16BrNO.
What is the molecular weight of n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide?
The molecular weight of n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide is 317.04 g/mol.
Where can I buy n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide?
You can request a quote for n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide?
Yes, KEHONG BIO provides custom synthesis services for n-((1r)-1-Phenylethyl)(3-bromo-4-methylphenyl)carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.