1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine
TL;DR: 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine (CAS 59261-43-7) is a chemical compound with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-dioxolan-2-yl)-4-methylisoquinolin-5-amine
Also Known As: 1-(1,3-dioxolan-2-yl)-4-methylisoquinolin-5-amine, 1-(1,3-dioxolan-2-yl)-4-methyl-5-isoquinolinamine, 1-(1,3-dioxolan-2-yl)-4-methyl-isoquinolin-5-amine, [1-(1,3-dioxolan-2-yl)-4-methyl-5-isoquinolyl]amine
| Molecular Formula | C13H14N2O2 |
|---|---|
| Molecular Weight | 230.11 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 57.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.10553 |
| Heavy Atoms | 17 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 59261-43-7 |
|---|---|
| SMILES | CC1=CN=C(C2=C1C(=CC=C2)N)C3OCCO3 |
| InChIKey | CHTFMVQQJMQEST-UHFFFAOYSA-N |
Product Overview
1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine (CAS 59261-43-7), with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol. IUPAC: 1-(1,3-dioxolan-2-yl)-4-methylisoquinolin-5-amine.
Chemical Property Profile of 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine
Property Insights of 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine. With a topological polar surface area (TPSA) of 57.4 Ų, 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine 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 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine?
The CAS number of 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine is 59261-43-7.
What is the molecular formula of 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine?
The molecular formula of 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine is C13H14N2O2.
What is the molecular weight of 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine?
The molecular weight of 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine is 230.11 g/mol.
Where can I buy 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine?
You can request a quote for 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Dioxolan-2-yl)-4-methylisoquinolin-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.