2-(Chloromethyl)-4-methylquinazoline
TL;DR: 2-(Chloromethyl)-4-methylquinazoline (CAS 109113-72-6) is a chemical compound with molecular formula C10H9ClN2 and molecular weight 192.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(chloromethyl)-4-methylquinazoline
Also Known As: 2-(chloromethyl)-4-methylquinazoline, Linagliptin Impurity 32, Linagliptin Impurity 67, Quinazoline, 2-(chloromethyl)-4-methyl-, 2-(chloromethyl)-4-methyl-quinazoline
| Molecular Formula | C10H9ClN2 |
|---|---|
| Molecular Weight | 192.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.04543 |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 109113-72-6 |
|---|---|
| SMILES | CC1=NC(=NC2=CC=CC=C12)CCl |
| InChIKey | UHCUBOJGMLASBY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Chloromethyl)-4-methylquinazoline (CAS 109113-72-6), with molecular formula C10H9ClN2 and molecular weight 192.05 g/mol. IUPAC: 2-(chloromethyl)-4-methylquinazoline.
Chemical Property Profile of 2-(Chloromethyl)-4-methylquinazoline
Property Insights of 2-(Chloromethyl)-4-methylquinazoline
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Chloromethyl)-4-methylquinazoline. With a topological polar surface area (TPSA) of 25.8 Ų, 2-(Chloromethyl)-4-methylquinazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Chloromethyl)-4-methylquinazoline 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)-4-methylquinazoline?
The CAS number of 2-(Chloromethyl)-4-methylquinazoline is 109113-72-6.
What is the molecular formula of 2-(Chloromethyl)-4-methylquinazoline?
The molecular formula of 2-(Chloromethyl)-4-methylquinazoline is C10H9ClN2.
What is the molecular weight of 2-(Chloromethyl)-4-methylquinazoline?
The molecular weight of 2-(Chloromethyl)-4-methylquinazoline is 192.05 g/mol.
Where can I buy 2-(Chloromethyl)-4-methylquinazoline?
You can request a quote for 2-(Chloromethyl)-4-methylquinazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Chloromethyl)-4-methylquinazoline?
Yes, KEHONG BIO provides custom synthesis services for 2-(Chloromethyl)-4-methylquinazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.