3-amino-6-fluoro-2-methylquinazolin-4(3H)-one
TL;DR: 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one (CAS 459414-73-4) is a chemical compound with molecular formula C9H8FN3O and molecular weight 193.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-6-fluoro-2-methylquinazolin-4-one
Also Known As: 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one, 3-amino-6-fluoro-2-methyl-3,4-dihydroquinazolin-4-one, 3-amino-6-fluoro-2-methylquinazolin-4-one, 4(3H)-quinazolinone, 3-amino-6-fluoro-2-methyl-, 3-amino-6-fluoro-2-methyl-quinazolin-4-one
| Molecular Formula | C9H8FN3O |
|---|---|
| Molecular Weight | 193.07 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 58.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 193.06514 |
| Heavy Atoms | 14 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 459414-73-4 |
|---|---|
| SMILES | CC1=NC2=C(C=C(C=C2)F)C(=O)N1N |
| InChIKey | VDDWAGDCXKFEOR-UHFFFAOYSA-N |
Product Overview
3-amino-6-fluoro-2-methylquinazolin-4(3H)-one (CAS 459414-73-4), with molecular formula C9H8FN3O and molecular weight 193.07 g/mol. IUPAC: 3-amino-6-fluoro-2-methylquinazolin-4-one.
Chemical Property Profile of 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one
Property Insights of 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one. With a topological polar surface area (TPSA) of 58.7 Ų, 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one has 1 hydrogen bond donor(s) and 4 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 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one?
The CAS number of 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one is 459414-73-4.
What is the molecular formula of 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one?
The molecular formula of 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one is C9H8FN3O.
What is the molecular weight of 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one?
The molecular weight of 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one is 193.07 g/mol.
Where can I buy 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one?
You can request a quote for 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-amino-6-fluoro-2-methylquinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.