4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)-
TL;DR: 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)- (CAS 108445-77-8) is a chemical compound with molecular formula C24H28ClN3O5 and molecular weight 473.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)imino-9,10-dimethoxy-3,7-dimethyl-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one;hydrochloride
Also Known As: 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)-, 2-(3,4-dimethoxyphenyl)imino-9,10-dimethoxy-3,7-dimethyl-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one hydrochloride
| Molecular Formula | C24H28ClN3O5 |
|---|---|
| Molecular Weight | 473.17 g/mol |
| LogP | 3.6595 |
| Topological Polar Surface Area | 76.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 473.17175 |
| Heavy Atoms | 33 |
| Complexity | 1312.6726 |
Chemical Identifiers
| CAS Number | 108445-77-8 |
|---|---|
| SMILES | CC1CN2C(=CC(=NC3=CC(=C(C=C3)OC)OC)N(C2=O)C)C4=CC(=C(C=C14)OC)OC.Cl |
Product Overview
4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)- (CAS 108445-77-8), with molecular formula C24H28ClN3O5 and molecular weight 473.17 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)imino-9,10-dimethoxy-3,7-dimethyl-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one;hydrochloride.
Chemical Property Profile of 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)-
Property Insights of 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)-
The XLogP value of 3.6595 indicates that 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)-. Following Lipinski's Rule of Five, 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)- has 0 hydrogen bond donor(s) and 6 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 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)-?
The CAS number of 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)- is 108445-77-8.
What is the molecular formula of 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)-?
The molecular formula of 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)- is C24H28ClN3O5.
What is the molecular weight of 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)-?
The molecular weight of 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)- is 473.17 g/mol.
Where can I buy 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)-?
You can request a quote for 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-2-((3,4-dimethoxyphenyl)imino)-3,7-dimethyl-, monohydrochloride, (+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.