C28H29BrN2O3
TL;DR: C28H29BrN2O3 (CAS 845983-18-8) is a chemical compound with molecular formula C28H29BrN2O3 and molecular weight 520.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(2-bromo-4,6-dimethylphenoxy)pentyl]-2-(4-methoxyphenyl)quinazolin-4-one
Also Known As: 3-(5-(2-bromo-4,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one, 3-[5-(2-bromo-4,6-dimethyl-phenoxy)pentyl]-2-(4-methoxyphenyl)quinazolin-4-one, 3-[5-(2-bromo-4,6-dimethylphenoxy)pentyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one, 3-[5-(2-bromo-4,6-dimethylphenoxy)pentyl]-2-(4-methoxyphenyl)quinazolin-4-one
| Molecular Formula | C28H29BrN2O3 |
|---|---|
| Molecular Weight | 520.14 g/mol |
| LogP | 6.70074 |
| Topological Polar Surface Area | 53.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 520.13617 |
| Heavy Atoms | 34 |
| Complexity | 1323.3591 |
Chemical Identifiers
| CAS Number | 845983-18-8 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)Br)OCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)C |
Product Overview
C28H29BrN2O3 (CAS 845983-18-8), with molecular formula C28H29BrN2O3 and molecular weight 520.14 g/mol. IUPAC: 3-[5-(2-bromo-4,6-dimethylphenoxy)pentyl]-2-(4-methoxyphenyl)quinazolin-4-one.
Chemical Property Profile of C28H29BrN2O3
Property Insights of C28H29BrN2O3
The XLogP value of 6.70074 indicates that C28H29BrN2O3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.35 Ų, C28H29BrN2O3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C28H29BrN2O3 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C28H29BrN2O3?
The CAS number of C28H29BrN2O3 is 845983-18-8.
What is the molecular formula of C28H29BrN2O3?
The molecular formula of C28H29BrN2O3 is C28H29BrN2O3.
What is the molecular weight of C28H29BrN2O3?
The molecular weight of C28H29BrN2O3 is 520.14 g/mol.
Where can I buy C28H29BrN2O3?
You can request a quote for C28H29BrN2O3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C28H29BrN2O3?
Yes, KEHONG BIO provides custom synthesis services for C28H29BrN2O3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.