TL;DR: 6-Fluoroquinazoline-2,4-diamine (CAS 119584-77-9) is a chemical compound with molecular formula C8H7FN4 and molecular weight 178.06548 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-fluoroquinazoline-2,4-diamine
Also Known As: 6-fluoroquinazoline-2,4-diamine, 2,4-Diamino-6-fluoroquinazoline, 2,4-Quinazolinediamine, 6-fluoro-, 2,4-Quinazolinediamine,6-fluoro-, 3360AA
| Molecular Formula | C8H7FN4 |
| Molecular Weight | 178.06548 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 77.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.06548 Da |
| Heavy Atoms | 13 |
| Complexity | 189.0 |
| SMILES | C1=CC2=C(C=C1F)C(=NC(=N2)N)N |
| InChIKey | MFEFVGSUKKCJMU-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Fluoroquinazoline-2,4-diamine. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Fluoroquinazoline-2,4-diamine. Following Lipinski's Rule of Five, 6-Fluoroquinazoline-2,4-diamine has 2 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-Fluoroquinazoline-2,4-diamine is 119584-77-9.
The molecular formula of 6-Fluoroquinazoline-2,4-diamine is C8H7FN4.
The molecular weight of 6-Fluoroquinazoline-2,4-diamine is 178.06548 g/mol.
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