3-Butyl-2-hydroxyquinazolin-4(3h)-one
TL;DR: 3-Butyl-2-hydroxyquinazolin-4(3h)-one (CAS 6944-59-8) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butyl-1H-quinazoline-2,4-dione
Also Known As: 3-butyl-2-hydroxyquinazolin-4(3h)-one, 3-butyl-1H-quinazoline-2,4-dione, 3-butyl-2-hydroxy-3,4-dihydroquinazolin-4-one, 3-butylquinazoline-2,4(1H,3H)-dione, 3-butyl-2,4(1H,3H)-quinazolinedione
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 6944-59-8 |
|---|---|
| SMILES | CCCCN1C(=O)C2=CC=CC=C2NC1=O |
| InChIKey | DSSUNKPFKROAGO-UHFFFAOYSA-N |
Product Overview
3-Butyl-2-hydroxyquinazolin-4(3h)-one (CAS 6944-59-8), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: 3-butyl-1H-quinazoline-2,4-dione.
Chemical Property Profile of 3-Butyl-2-hydroxyquinazolin-4(3h)-one
Property Insights of 3-Butyl-2-hydroxyquinazolin-4(3h)-one
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Butyl-2-hydroxyquinazolin-4(3h)-one. With a topological polar surface area (TPSA) of 49.4 Ų, 3-Butyl-2-hydroxyquinazolin-4(3h)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Butyl-2-hydroxyquinazolin-4(3h)-one has 1 hydrogen bond donor(s) and 2 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-Butyl-2-hydroxyquinazolin-4(3h)-one?
The CAS number of 3-Butyl-2-hydroxyquinazolin-4(3h)-one is 6944-59-8.
What is the molecular formula of 3-Butyl-2-hydroxyquinazolin-4(3h)-one?
The molecular formula of 3-Butyl-2-hydroxyquinazolin-4(3h)-one is C12H14N2O2.
What is the molecular weight of 3-Butyl-2-hydroxyquinazolin-4(3h)-one?
The molecular weight of 3-Butyl-2-hydroxyquinazolin-4(3h)-one is 218.11 g/mol.
Where can I buy 3-Butyl-2-hydroxyquinazolin-4(3h)-one?
You can request a quote for 3-Butyl-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-Butyl-2-hydroxyquinazolin-4(3h)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Butyl-2-hydroxyquinazolin-4(3h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.