3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione
TL;DR: 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione (CAS 214749-92-5) is a chemical compound with molecular formula C16H12N2O4 and molecular weight 296.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione
Also Known As: 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione, 3-(1,3-Benzodioxole-5-ylmethyl)quinazoline-2,4(1H,3H)-dione, 3-(1,3-benzodioxol-5-ylmethyl)quinazoline-2,4(1{H},3{H})-dione, F0921-6507, 3-(1,3-benzodioxol-5-ylmethyl)-2,4(1H,3H)-quinazolinedione
| Molecular Formula | C16H12N2O4 |
|---|---|
| Molecular Weight | 296.08 g/mol |
| LogP | 1.4668 |
| Topological Polar Surface Area | 73.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.0797 |
| Heavy Atoms | 22 |
| Complexity | 987.33777 |
Chemical Identifiers
| CAS Number | 214749-92-5 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4NC3=O |
Product Overview
3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione (CAS 214749-92-5), with molecular formula C16H12N2O4 and molecular weight 296.08 g/mol. IUPAC: 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione.
Chemical Property Profile of 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione
Property Insights of 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione
The XLogP value of 1.4668 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione. The TPSA of 73.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione. Following Lipinski's Rule of Five, 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione has 1 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 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione?
The CAS number of 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione is 214749-92-5.
What is the molecular formula of 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione?
The molecular formula of 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione is C16H12N2O4.
What is the molecular weight of 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione?
The molecular weight of 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione is 296.08 g/mol.
Where can I buy 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione?
You can request a quote for 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-benzodioxol-5-ylmethyl)-1H-quinazoline-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.