N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
TL;DR: N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine (CAS 153437-78-6) is a chemical compound with molecular formula C16H13ClFN3O2 and molecular weight 333.06802 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
Also Known As: Gefitinib Impurity D, Gefitinib Impurity II, Gefitinib Impurity 10, Gefitinib Impurity F, Gefitinib impurity 2
Technical Specifications
| Molecular Formula | C16H13ClFN3O2 |
| Molecular Weight | 333.06802 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 56.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.06802 Da |
| Heavy Atoms | 23 |
| Complexity | 392.0 |
| SMILES | COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)OC |
| InChIKey | VOPNWXZDJKCCRE-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
Property Insights of N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
The XLogP value of 4.1 indicates that N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.3 Ų, N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine?
The CAS number of N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine is 153437-78-6.
What is the molecular formula of N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine?
The molecular formula of N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine is C16H13ClFN3O2.
What is the molecular weight of N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine?
The molecular weight of N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine is 333.06802 g/mol.
Where can I buy N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine?
You can request a quote for N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine?
Yes, CoreyChem provides custom synthesis services for N-(3-chloro-4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.