RefChem:322056
TL;DR: RefChem:322056 (CAS 68501-56-4) is a chemical compound with molecular formula C24H20BrN3O4 and molecular weight 493.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[8-bromo-3-[2-(3,4-dihydroxyphenyl)ethyl]-4-oxoquinazolin-2-yl]methyl]benzamide
Also Known As: Benzamide, N-((8-bromo-3-(2-(3,4-dihydroxyphenyl)ethyl)-4-oxo-3,4-dihydro-2-quinazolinyl)methyl)-, N-[[8-bromo-3-[2-(3,4-dihydroxyphenyl)ethyl]-4-oxoquinazolin-2-yl]methyl]benzamide, N-({8-bromo-3-[2-(3,4-dihydroxyphenyl)ethyl]-4-oxo-3,4-dihydroquinazolin-2-yl}methyl)benzamide, BENZAMIDE, N-((8-BROMO-3-(2-(3,4-DIHYDROXYPHENYL)ETHYL)-4-OXO-3,4-DIHYDRO-2-QUIN, N-[[8-Bromo-3-[2-(3,4-dihydroxyphenyl)ethyl]-3,4-dihydro-4-oxoquinazolin-2-yl]methyl]benzamide
| Molecular Formula | C24H20BrN3O4 |
|---|---|
| Molecular Weight | 493.06 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.06372 |
| Heavy Atoms | 32 |
| Complexity | 711.0 |
Chemical Identifiers
| CAS Number | 68501-56-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NCC2=NC3=C(C=CC=C3Br)C(=O)N2CCC4=CC(=C(C=C4)O)O |
| InChIKey | GNRPHOUVINMUQL-UHFFFAOYSA-N |
Product Overview
RefChem:322056 (CAS 68501-56-4), with molecular formula C24H20BrN3O4 and molecular weight 493.06 g/mol. IUPAC: N-[[8-bromo-3-[2-(3,4-dihydroxyphenyl)ethyl]-4-oxoquinazolin-2-yl]methyl]benzamide.
Chemical Property Profile of RefChem:322056
Property Insights of RefChem:322056
The XLogP value of 3.8 indicates that RefChem:322056 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:322056. Following Lipinski's Rule of Five, RefChem:322056 has 3 hydrogen bond donor(s) and 5 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 RefChem:322056?
The CAS number of RefChem:322056 is 68501-56-4.
What is the molecular formula of RefChem:322056?
The molecular formula of RefChem:322056 is C24H20BrN3O4.
What is the molecular weight of RefChem:322056?
The molecular weight of RefChem:322056 is 493.06 g/mol.
Where can I buy RefChem:322056?
You can request a quote for RefChem:322056 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:322056?
Yes, KEHONG BIO provides custom synthesis services for RefChem:322056 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.