![Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate structure](/static/products/459/459418-69-0.png)
Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate
TL;DR: Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate (CAS 459418-69-0) is a chemical compound with molecular formula C20H20BrN3O2 and molecular weight 413.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate
Also Known As: pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate, pentyl 4-((6-bromoquinazolin-4-yl)amino)benzoate
| Molecular Formula | C20H20BrN3O2 |
|---|---|
| Molecular Weight | 413.07 g/mol |
| LogP | 5.4829 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 413.07388 |
| Heavy Atoms | 26 |
| Complexity | 897.2018 |
Chemical Identifiers
| CAS Number | 459418-69-0 |
|---|---|
| SMILES | CCCCCOC(=O)C1=CC=C(C=C1)NC2=NC=NC3=C2C=C(C=C3)Br |
Product Overview
Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate (CAS 459418-69-0), with molecular formula C20H20BrN3O2 and molecular weight 413.07 g/mol. IUPAC: pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate.
Chemical Property Profile of Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate
Property Insights of Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate
The XLogP value of 5.4829 indicates that Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate. Following Lipinski's Rule of Five, Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate?
The CAS number of Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate is 459418-69-0.
What is the molecular formula of Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate?
The molecular formula of Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate is C20H20BrN3O2.
What is the molecular weight of Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate?
The molecular weight of Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate is 413.07 g/mol.
Where can I buy Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate?
You can request a quote for Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Pentyl 4-[(6-bromoquinazolin-4-yl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.