![2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one structure](/static/products/765/76536-16-8.png)
2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
TL;DR: 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one (CAS 76536-16-8) is a chemical compound with molecular formula C18H23N3O3 and molecular weight 329.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9,10-dimethoxy-2-(2-methylpropylamino)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
Also Known As: 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one, 9,10-dimethoxy-2-(2-methylpropylamino)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one, 9,10-dimethoxy-2-[(2-methylpropyl)amino]-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
| Molecular Formula | C18H23N3O3 |
|---|---|
| Molecular Weight | 329.17 g/mol |
| LogP | 2.5515 |
| Topological Polar Surface Area | 65.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.17395 |
| Heavy Atoms | 24 |
| Complexity | 811.8868 |
Chemical Identifiers
| CAS Number | 76536-16-8 |
|---|---|
| SMILES | CC(C)CNC1=NC(=O)N2CCC3=CC(=C(C=C3C2=C1)OC)OC |
Product Overview
2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one (CAS 76536-16-8), with molecular formula C18H23N3O3 and molecular weight 329.17 g/mol. IUPAC: 9,10-dimethoxy-2-(2-methylpropylamino)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one.
Chemical Property Profile of 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Property Insights of 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
The XLogP value of 2.5515 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one. The TPSA of 65.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one. Following Lipinski's Rule of Five, 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one has 1 hydrogen bond donor(s) and 5 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 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one?
The CAS number of 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one is 76536-16-8.
What is the molecular formula of 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one?
The molecular formula of 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one is C18H23N3O3.
What is the molecular weight of 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one?
The molecular weight of 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one is 329.17 g/mol.
Where can I buy 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one?
You can request a quote for 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(isobutylamino)-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.