N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
TL;DR: N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine (CAS 690206-97-4) is a chemical compound with molecular formula C16H13ClFN3O2 and molecular weight 333.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
Also Known As: N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine, Gefitinib Impurity 20, Anilinoquinazoline deriv. 4, ZM-306416(CB 676475), HSCI1_000042
| Molecular Formula | C16H13ClFN3O2 |
|---|---|
| Molecular Weight | 333.07 g/mol |
| LogP | 4.1831 |
| Topological Polar Surface Area | 56.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.06802 |
| Heavy Atoms | 23 |
| Complexity | 873.3134 |
Chemical Identifiers
| CAS Number | 690206-97-4 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Cl)F)OC |
Product Overview
N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine (CAS 690206-97-4), with molecular formula C16H13ClFN3O2 and molecular weight 333.07 g/mol. IUPAC: N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine.
Chemical Property Profile of N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
Property Insights of N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
The XLogP value of 4.1831 indicates that N-(4-chloro-2-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 56.27 Ų, N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine has 1 hydrogen bond donor(s) and 5 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 N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine?
The CAS number of N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine is 690206-97-4.
What is the molecular formula of N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine?
The molecular formula of N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine is C16H13ClFN3O2.
What is the molecular weight of N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine?
The molecular weight of N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine is 333.07 g/mol.
Where can I buy N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine?
You can request a quote for N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chloro-2-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.