benzyl (4-oxoquinazolin-3(4H)-yl)acetate
TL;DR: benzyl (4-oxoquinazolin-3(4H)-yl)acetate (CAS 370848-59-2) is a chemical compound with molecular formula C17H14N2O3 and molecular weight 294.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-(4-oxoquinazolin-3-yl)acetate
Also Known As: TimTec1_007744, IDI1_033398, benzyl 2-(4-oxoquinazolin-3-yl)acetate, BAS 03013254, benzyl 2-(4-oxoquinazolin-3(4H)-yl)acetate
| Molecular Formula | C17H14N2O3 |
|---|---|
| Molecular Weight | 294.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 294.10043 |
| Heavy Atoms | 22 |
| Complexity | 443.0 |
Chemical Identifiers
| CAS Number | 370848-59-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CN2C=NC3=CC=CC=C3C2=O |
| InChIKey | JZHSTVIWJPSBEW-UHFFFAOYSA-N |
Product Overview
benzyl (4-oxoquinazolin-3(4H)-yl)acetate (CAS 370848-59-2), with molecular formula C17H14N2O3 and molecular weight 294.10 g/mol. IUPAC: benzyl 2-(4-oxoquinazolin-3-yl)acetate.
Chemical Property Profile of benzyl (4-oxoquinazolin-3(4H)-yl)acetate
Property Insights of benzyl (4-oxoquinazolin-3(4H)-yl)acetate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for benzyl (4-oxoquinazolin-3(4H)-yl)acetate. With a topological polar surface area (TPSA) of 59.0 Ų, benzyl (4-oxoquinazolin-3(4H)-yl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, benzyl (4-oxoquinazolin-3(4H)-yl)acetate has 0 hydrogen bond donor(s) and 4 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 benzyl (4-oxoquinazolin-3(4H)-yl)acetate?
The CAS number of benzyl (4-oxoquinazolin-3(4H)-yl)acetate is 370848-59-2.
What is the molecular formula of benzyl (4-oxoquinazolin-3(4H)-yl)acetate?
The molecular formula of benzyl (4-oxoquinazolin-3(4H)-yl)acetate is C17H14N2O3.
What is the molecular weight of benzyl (4-oxoquinazolin-3(4H)-yl)acetate?
The molecular weight of benzyl (4-oxoquinazolin-3(4H)-yl)acetate is 294.10 g/mol.
Where can I buy benzyl (4-oxoquinazolin-3(4H)-yl)acetate?
You can request a quote for benzyl (4-oxoquinazolin-3(4H)-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for benzyl (4-oxoquinazolin-3(4H)-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for benzyl (4-oxoquinazolin-3(4H)-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.