4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one
TL;DR: 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one (CAS 1391052-18-8) is a chemical compound with molecular formula C14H16N2O2 and molecular weight 244.12119 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-amino-2-methyl-3-(3-oxobutyl)-1H-quinolin-4-one
Also Known As: 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one, 1-[3-(Hexyloxy)phenyl]ethanone, 4-(6-amino-4-hydroxy-2-methylquinolin-3-yl)butan-2-one, Rasagiline 13C3 Mesylate (Racemic), BAS 00733462
Technical Specifications
| Molecular Formula | C14H16N2O2 |
| Molecular Weight | 244.12119 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 72.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.12119 Da |
| Heavy Atoms | 18 |
| Complexity | 401.0 |
| SMILES | CC1=C(C(=O)C2=C(N1)C=CC(=C2)N)CCC(=O)C |
| InChIKey | KPXPUAOOEMFAQW-UHFFFAOYSA-N |
Chemical Property Profile of 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one
Property Insights of 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one. Following Lipinski's Rule of Five, 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one has 2 hydrogen bond donor(s) and 4 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-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one?
The CAS number of 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one is 1391052-18-8.
What is the molecular formula of 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one?
The molecular formula of 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one is C14H16N2O2.
What is the molecular weight of 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one?
The molecular weight of 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one is 244.12119 g/mol.
Where can I buy 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one?
You can request a quote for 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one?
Yes, CoreyChem provides custom synthesis services for 4-(6-Amino-4-hydroxy-2-methyl-quinolin-3-yl)-butan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.