(4-Bromophenyl)methyl 2-(propanoylamino)benzoate
TL;DR: (4-Bromophenyl)methyl 2-(propanoylamino)benzoate (CAS 650595-15-6) is a chemical compound with molecular formula C17H16BrNO3 and molecular weight 361.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)methyl 2-(propanoylamino)benzoate
Also Known As: (4-bromophenyl)methyl 2-(propanoylamino)benzoate, 4-bromobenzyl 2-(propionylamino)benzoate, 4-bromobenzyl 2-propionamidobenzoate, 4-bromobenzyl 2-(propanoylamino)benzoate, AH-487/42277225
| Molecular Formula | C17H16BrNO3 |
|---|---|
| Molecular Weight | 361.03 g/mol |
| LogP | 4.1546 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 361.03137 |
| Heavy Atoms | 22 |
| Complexity | 667.8592 |
Chemical Identifiers
| CAS Number | 650595-15-6 |
|---|---|
| SMILES | CCC(=O)NC1=CC=CC=C1C(=O)OCC2=CC=C(C=C2)Br |
Product Overview
(4-Bromophenyl)methyl 2-(propanoylamino)benzoate (CAS 650595-15-6), with molecular formula C17H16BrNO3 and molecular weight 361.03 g/mol. IUPAC: (4-bromophenyl)methyl 2-(propanoylamino)benzoate.
Chemical Property Profile of (4-Bromophenyl)methyl 2-(propanoylamino)benzoate
Property Insights of (4-Bromophenyl)methyl 2-(propanoylamino)benzoate
The XLogP value of 4.1546 indicates that (4-Bromophenyl)methyl 2-(propanoylamino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, (4-Bromophenyl)methyl 2-(propanoylamino)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Bromophenyl)methyl 2-(propanoylamino)benzoate 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 (4-Bromophenyl)methyl 2-(propanoylamino)benzoate?
The CAS number of (4-Bromophenyl)methyl 2-(propanoylamino)benzoate is 650595-15-6.
What is the molecular formula of (4-Bromophenyl)methyl 2-(propanoylamino)benzoate?
The molecular formula of (4-Bromophenyl)methyl 2-(propanoylamino)benzoate is C17H16BrNO3.
What is the molecular weight of (4-Bromophenyl)methyl 2-(propanoylamino)benzoate?
The molecular weight of (4-Bromophenyl)methyl 2-(propanoylamino)benzoate is 361.03 g/mol.
Where can I buy (4-Bromophenyl)methyl 2-(propanoylamino)benzoate?
You can request a quote for (4-Bromophenyl)methyl 2-(propanoylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Bromophenyl)methyl 2-(propanoylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Bromophenyl)methyl 2-(propanoylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.