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Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate
TL;DR: Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate (CAS 444058-33-7) is a chemical compound with molecular formula C18H18BrNO3 and molecular weight 375.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate
Also Known As: TimTec1_004015, propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate, AN-329/41006784, BRD-K31839208-001-01-7, PROPYL 4-(3-BROMO-4-METHYLBENZAMIDO)BENZOATE
| Molecular Formula | C18H18BrNO3 |
|---|---|
| Molecular Weight | 375.05 g/mol |
| LogP | 4.57662 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.047 |
| Heavy Atoms | 23 |
| Complexity | 710.70667 |
Chemical Identifiers
| CAS Number | 444058-33-7 |
|---|---|
| SMILES | CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)C)Br |
Product Overview
Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate (CAS 444058-33-7), with molecular formula C18H18BrNO3 and molecular weight 375.05 g/mol. IUPAC: propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate.
Chemical Property Profile of Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate
Property Insights of Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate
The XLogP value of 4.57662 indicates that Propyl 4-[(3-bromo-4-methylbenzoyl)amino]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, Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propyl 4-[(3-bromo-4-methylbenzoyl)amino]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 Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate?
The CAS number of Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate is 444058-33-7.
What is the molecular formula of Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate?
The molecular formula of Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate is C18H18BrNO3.
What is the molecular weight of Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate?
The molecular weight of Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate is 375.05 g/mol.
Where can I buy Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate?
You can request a quote for Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 4-[(3-bromo-4-methylbenzoyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.