3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate
TL;DR: 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate (CAS 692289-64-8) is a chemical compound with molecular formula C18H17Cl2NO3 and molecular weight 365.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dichlorophenyl)methyl 4-methyl-3-(propanoylamino)benzoate
Also Known As: 3,4-dichlorobenzyl 4-methyl-3-(propionylamino)benzoate, 3,4-dichlorobenzyl 4-methyl-3-propionamidobenzoate, (3,4-dichlorophenyl)methyl 4-methyl-3-(propanoylamino)benzoate
| Molecular Formula | C18H17Cl2NO3 |
|---|---|
| Molecular Weight | 365.06 g/mol |
| LogP | 5.00732 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.05856 |
| Heavy Atoms | 24 |
| Complexity | 774.8544 |
Chemical Identifiers
| CAS Number | 692289-64-8 |
|---|---|
| SMILES | CCC(=O)NC1=C(C=CC(=C1)C(=O)OCC2=CC(=C(C=C2)Cl)Cl)C |
Product Overview
3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate (CAS 692289-64-8), with molecular formula C18H17Cl2NO3 and molecular weight 365.06 g/mol. IUPAC: (3,4-dichlorophenyl)methyl 4-methyl-3-(propanoylamino)benzoate.
Chemical Property Profile of 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate
Property Insights of 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate
The XLogP value of 5.00732 indicates that 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)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, 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate?
The CAS number of 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate is 692289-64-8.
What is the molecular formula of 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate?
The molecular formula of 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate is C18H17Cl2NO3.
What is the molecular weight of 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate?
The molecular weight of 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate is 365.06 g/mol.
Where can I buy 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate?
You can request a quote for 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dichlorobenzyl 4-methyl-3-(propionylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.