![3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one structure](/static/products/879/879474-98-3.png)
3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one
TL;DR: 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one (CAS 879474-98-3) is a chemical compound with molecular formula C16H19N3O3 and molecular weight 301.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(azepan-1-yl)-2-oxoethyl]-1H-quinazoline-2,4-dione
Also Known As: AB01302861-01, 3-[2-(azepan-1-yl)-2-oxoethyl]-1H-quinazoline-2,4-dione, 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one, 3-(2-(azepan-1-yl)-2-oxoethyl)quinazoline-2,4(1H,3H)-dione
| Molecular Formula | C16H19N3O3 |
|---|---|
| Molecular Weight | 301.14 g/mol |
| LogP | 1.0924 |
| Topological Polar Surface Area | 75.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.14264 |
| Heavy Atoms | 22 |
| Complexity | 798.1236 |
Chemical Identifiers
| CAS Number | 879474-98-3 |
|---|---|
| SMILES | C1CCCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3NC2=O |
Product Overview
3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one (CAS 879474-98-3), with molecular formula C16H19N3O3 and molecular weight 301.14 g/mol. IUPAC: 3-[2-(azepan-1-yl)-2-oxoethyl]-1H-quinazoline-2,4-dione.
Chemical Property Profile of 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one
Property Insights of 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one
The XLogP value of 1.0924 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one. The TPSA of 75.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one. Following Lipinski's Rule of Five, 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one has 1 hydrogen bond donor(s) and 3 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 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one?
The CAS number of 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one is 879474-98-3.
What is the molecular formula of 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one?
The molecular formula of 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one is C16H19N3O3.
What is the molecular weight of 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one?
The molecular weight of 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one is 301.14 g/mol.
Where can I buy 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one?
You can request a quote for 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(azepan-1-yl)-2-oxoethyl]-2-hydroxyquinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.