5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride
TL;DR: 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride (CAS 55165-22-5) is a chemical compound with molecular formula C25H25Cl2N3O4 and molecular weight 501.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-1-(7-methyl-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-N-[(7-methyl-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]methanamine;dihydrochloride
Also Known As: 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride, 1,3-Dioxolo(4,5-g)isoquinoline, 5,5'-((methylimino)dimethylene)bis(7-methyl-, dihydrochloride, n-methyl-1-(7-methyl[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-n-[(7-methyl[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]methanamine dihydrochloride, N-methyl-1-(7-methyl-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-N-[(7-methyl-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]methanamine dihydrochloride, N-Methyl-1-(7-methyl-2H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-N-[(7-methyl-2H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]methanamine--hydrogen chloride (1/2)
| Molecular Formula | C25H25Cl2N3O4 |
|---|---|
| Molecular Weight | 501.12 g/mol |
| LogP | 5.33284 |
| Topological Polar Surface Area | 65.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 501.12222 |
| Heavy Atoms | 34 |
| Complexity | 613.0 |
Chemical Identifiers
| CAS Number | 55165-22-5 |
|---|---|
| SMILES | CC1=CC2=CC3=C(C=C2C(=N1)CN(C)CC4=NC(=CC5=CC6=C(C=C54)OCO6)C)OCO3.Cl.Cl |
| InChIKey | MBHPUROEJMICMC-UHFFFAOYSA-N |
Product Overview
5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride (CAS 55165-22-5), with molecular formula C25H25Cl2N3O4 and molecular weight 501.12 g/mol. IUPAC: N-methyl-1-(7-methyl-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-N-[(7-methyl-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]methanamine;dihydrochloride.
Chemical Property Profile of 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride
Property Insights of 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride
The XLogP value of 5.33284 indicates that 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride. Following Lipinski's Rule of Five, 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride?
The CAS number of 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride is 55165-22-5.
What is the molecular formula of 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride?
The molecular formula of 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride is C25H25Cl2N3O4.
What is the molecular weight of 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride?
The molecular weight of 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride is 501.12 g/mol.
Where can I buy 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride?
You can request a quote for 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 5,5'-((Methylimino)dimethylene)bis(7-methyl-1,3-dioxolo(4,5-g)isoquinoline) dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.