4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate
TL;DR: 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate (CAS 16347-79-8) is a chemical compound with molecular formula C36H28N4O10 and molecular weight 676.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetic acid;bis([2-(4-oxoquinazoline-3-carbonyl)phenyl] acetate)
Also Known As: 3-(o-Hydroxybenzoyl)-4(3H)-quinazolinone acetate hemiacetate, 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate, C17H12N2O4.1/2C2H4O2, C17-H12-N2-O4.1/2C2-H4-O2, acetic acid; [2-(4-oxoquinazoline-3-carbonyl)phenyl] acetate
| Molecular Formula | C36H28N4O10 |
|---|---|
| Molecular Weight | 676.18 g/mol |
| LogP | 4.11 |
| Topological Polar Surface Area | 189.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 676.18054 |
| Heavy Atoms | 50 |
| Complexity | 562.0 |
Chemical Identifiers
| CAS Number | 16347-79-8 |
|---|---|
| SMILES | CC(=O)O.CC(=O)OC1=CC=CC=C1C(=O)N2C=NC3=CC=CC=C3C2=O.CC(=O)OC1=CC=CC=C1C(=O)N2C=NC3=CC=CC=C3C2=O |
| InChIKey | VBLLMOSHELODIE-UHFFFAOYSA-N |
Product Overview
4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate (CAS 16347-79-8), with molecular formula C36H28N4O10 and molecular weight 676.18 g/mol. IUPAC: acetic acid;bis([2-(4-oxoquinazoline-3-carbonyl)phenyl] acetate).
Chemical Property Profile of 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate
Property Insights of 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate
The XLogP value of 4.11 indicates that 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 189.0 Ų indicates high polarity, suggesting 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate has 1 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate?
The CAS number of 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate is 16347-79-8.
What is the molecular formula of 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate?
The molecular formula of 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate is C36H28N4O10.
What is the molecular weight of 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate?
The molecular weight of 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate is 676.18 g/mol.
Where can I buy 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate?
You can request a quote for 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinone, 3-(o-hydroxybenzoyl)-, acetate, hemiacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.