RefChem:1069176
TL;DR: RefChem:1069176 (CAS 81958-18-1) is a chemical compound with molecular formula C30H19BrClN3O and molecular weight 551.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-2-[(E)-2-[2-(4-chlorophenyl)-1H-indol-3-yl]ethenyl]-3-phenylquinazolin-4-one
Also Known As: 6-Bromo-2-(2-(2-(4-chlorophenyl)-1H-indol-3-yl)ethenyl)-3-phenyl-4(3H)-quinazolinone, 4(3H)-Quinazolinone, 6-bromo-2-(2-(2-(4-chlorophenyl)-1H-indol-3-yl)ethenyl)-3-phenyl-, 6-bromo-2-[(E)-2-[2-(4-chlorophenyl)-1H-indol-3-yl]ethenyl]-3-phenylquinazolin-4-one, RefChem:1069176
| Molecular Formula | C30H19BrClN3O |
|---|---|
| Molecular Weight | 551.04 g/mol |
| LogP | 8.1203 |
| Topological Polar Surface Area | 50.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 551.04 |
| Heavy Atoms | 36 |
| Complexity | 1819.8796 |
Chemical Identifiers
| CAS Number | 81958-18-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)Br)/C=C/C4=C(NC5=CC=CC=C54)C6=CC=C(C=C6)Cl |
Product Overview
RefChem:1069176 (CAS 81958-18-1), with molecular formula C30H19BrClN3O and molecular weight 551.04 g/mol. IUPAC: 6-bromo-2-[(E)-2-[2-(4-chlorophenyl)-1H-indol-3-yl]ethenyl]-3-phenylquinazolin-4-one.
Chemical Property Profile of RefChem:1069176
Property Insights of RefChem:1069176
The XLogP value of 8.1203 indicates that RefChem:1069176 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.68 Ų, RefChem:1069176 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1069176 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1069176?
The CAS number of RefChem:1069176 is 81958-18-1.
What is the molecular formula of RefChem:1069176?
The molecular formula of RefChem:1069176 is C30H19BrClN3O.
What is the molecular weight of RefChem:1069176?
The molecular weight of RefChem:1069176 is 551.04 g/mol.
Where can I buy RefChem:1069176?
You can request a quote for RefChem:1069176 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1069176?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1069176 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.