2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide
TL;DR: 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide (CAS 94206-84-5) is a chemical compound with molecular formula C16H13ClN2O and molecular weight 284.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(chloromethyl)-6-methyl-3-oxido-4-phenylquinazolin-3-ium
Also Known As: 2-(Chloromethyl)-6-methyl-4-phenyl-quinazoline 3-Oxide, 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide, BAS 00163884, 2-(chloromethyl)-6-methyl-3-oxido-4-phenylquinazolin-3-ium, 2-(chloromethyl)-6-methyl-4-phenylquinazolin-3-ol
| Molecular Formula | C16H13ClN2O |
|---|---|
| Molecular Weight | 284.07 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 38.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.07166 |
| Heavy Atoms | 20 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 94206-84-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C([N+](=C2C3=CC=CC=C3)[O-])CCl |
| InChIKey | WFFWEEOVGFHGGZ-UHFFFAOYSA-N |
Product Overview
2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide (CAS 94206-84-5), with molecular formula C16H13ClN2O and molecular weight 284.07 g/mol. IUPAC: 2-(chloromethyl)-6-methyl-3-oxido-4-phenylquinazolin-3-ium.
Chemical Property Profile of 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide
Property Insights of 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide
The XLogP value of 3.0 indicates that 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.4 Ų, 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide has 0 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 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide?
The CAS number of 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide is 94206-84-5.
What is the molecular formula of 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide?
The molecular formula of 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide is C16H13ClN2O.
What is the molecular weight of 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide?
The molecular weight of 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide is 284.07 g/mol.
Where can I buy 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide?
You can request a quote for 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloromethyl-6-methyl-4-phenyl-quinazoline 3-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.