4-(3-Bromoanilino)-6,7-diethoxyquinazoline
TL;DR: 4-(3-Bromoanilino)-6,7-diethoxyquinazoline (CAS 171745-13-4) is a chemical compound with molecular formula C18H18BrN3O2 and molecular weight 387.05823 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-bromophenyl)-6,7-diethoxyquinazolin-4-amine
Also Known As: compound 56, N-(3-bromophenyl)-6,7-diethoxyquinazolin-4-amine, EGFR-IN-80, 4-[(3-Bromophenyl)amino]-6,7-diethoxyquinazoline, 4-BrBzN-6,7-diEtOQ
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H18BrN3O2 |
| Molecular Weight | 387.05823 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 56.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.05823 Da |
| Heavy Atoms | 24 |
| Complexity | 387.0 |
| SMILES | CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)Br)OCC |
| InChIKey | YXOXHAUUTIOBDA-UHFFFAOYSA-N |
Chemical Property Profile of 4-(3-Bromoanilino)-6,7-diethoxyquinazoline
Property Insights of 4-(3-Bromoanilino)-6,7-diethoxyquinazoline
The XLogP value of 4.8 indicates that 4-(3-Bromoanilino)-6,7-diethoxyquinazoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.3 Ų, 4-(3-Bromoanilino)-6,7-diethoxyquinazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3-Bromoanilino)-6,7-diethoxyquinazoline 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
What is the CAS number of 4-(3-Bromoanilino)-6,7-diethoxyquinazoline?
The CAS number of 4-(3-Bromoanilino)-6,7-diethoxyquinazoline is 171745-13-4.
What is the molecular formula of 4-(3-Bromoanilino)-6,7-diethoxyquinazoline?
The molecular formula of 4-(3-Bromoanilino)-6,7-diethoxyquinazoline is C18H18BrN3O2.
What is the molecular weight of 4-(3-Bromoanilino)-6,7-diethoxyquinazoline?
The molecular weight of 4-(3-Bromoanilino)-6,7-diethoxyquinazoline is 387.05823 g/mol.
Where can I buy 4-(3-Bromoanilino)-6,7-diethoxyquinazoline?
You can request a quote for 4-(3-Bromoanilino)-6,7-diethoxyquinazoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(3-Bromoanilino)-6,7-diethoxyquinazoline?
Yes, CoreyChem provides custom synthesis services for 4-(3-Bromoanilino)-6,7-diethoxyquinazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.