TL;DR: 6,7-dimethoxy-N-phenylquinazolin-4-amine (CAS 21561-09-1) is a chemical compound with molecular formula C16H15N3O2 and molecular weight 281.11642 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7-dimethoxy-N-phenylquinazolin-4-amine
Also Known As: WHI-P258, 6,7-dimethoxy-N-phenylquinazolin-4-amine, 4-Phenylamino-6,7-dimethoxyquinazoline, 4-Quinazolinamine, 6,7-dimethoxy-N-phenyl-, WHI-P 258
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H15N3O2 |
| Molecular Weight | 281.11642 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 56.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.11642 Da |
| Heavy Atoms | 21 |
| Complexity | 323.0 |
| SMILES | COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC=C3)OC |
| InChIKey | MJKCGAHOCZLYDG-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 6,7-dimethoxy-N-phenylquinazolin-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, 6,7-dimethoxy-N-phenylquinazolin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-dimethoxy-N-phenylquinazolin-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.
The CAS number of 6,7-dimethoxy-N-phenylquinazolin-4-amine is 21561-09-1.
The molecular formula of 6,7-dimethoxy-N-phenylquinazolin-4-amine is C16H15N3O2.
The molecular weight of 6,7-dimethoxy-N-phenylquinazolin-4-amine is 281.11642 g/mol.
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