Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide
TL;DR: Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide (CAS 6327-38-4) is a chemical compound with molecular formula C15H20N2OS and molecular weight 276.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2-(3-methylbutylsulfanylmethyl)-3-oxidoquinazolin-3-ium
Also Known As: Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide, 4-methyl-2-(3-methylbutylsulfanylmethyl)-3-oxidoquinazolin-3-ium, Quinazoline,4-methyl-2-[[(3-methylbutyl)thio]methyl]-, 3-oxide, 4-Methyl-2-{[(3-methylbutyl)sulfanyl]methyl}-3-oxo-3lambda~5~-quinazoline, RefChem:178171
| Molecular Formula | C15H20N2OS |
|---|---|
| Molecular Weight | 276.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 276.12964 |
| Heavy Atoms | 19 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 6327-38-4 |
|---|---|
| SMILES | CC1=[N+](C(=NC2=CC=CC=C12)CSCCC(C)C)[O-] |
| InChIKey | HOFGXXTVLSOQFC-UHFFFAOYSA-N |
Product Overview
Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide (CAS 6327-38-4), with molecular formula C15H20N2OS and molecular weight 276.13 g/mol. IUPAC: 4-methyl-2-(3-methylbutylsulfanylmethyl)-3-oxidoquinazolin-3-ium.
Chemical Property Profile of Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide
Property Insights of Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide
The XLogP value of 3.1 indicates that Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide. Following Lipinski's Rule of Five, Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide has 0 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 Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide?
The CAS number of Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide is 6327-38-4.
What is the molecular formula of Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide?
The molecular formula of Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide is C15H20N2OS.
What is the molecular weight of Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide?
The molecular weight of Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide is 276.13 g/mol.
Where can I buy Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide?
You can request a quote for Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide?
Yes, KEHONG BIO provides custom synthesis services for Quinazoline, 4-methyl-2-(((3-methylbutyl)thio)methyl)-, 3-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.