1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-
TL;DR: 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl- (CAS 90832-54-5) is a chemical compound with molecular formula C11H11NO2 and molecular weight 189.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline
Also Known As: 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-, 7-methyl-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline, 7-methyl-7,8-dihydro-1,3-dioxolo[4,5-g]isoquinoline, 7-Methyl-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]isoquinoline
| Molecular Formula | C11H11NO2 |
|---|---|
| Molecular Weight | 189.08 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 30.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 189.07898 |
| Heavy Atoms | 14 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 90832-54-5 |
|---|---|
| SMILES | CC1CC2=CC3=C(C=C2C=N1)OCO3 |
| InChIKey | GJYMGPVIFSJHGS-UHFFFAOYSA-N |
Product Overview
1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl- (CAS 90832-54-5), with molecular formula C11H11NO2 and molecular weight 189.08 g/mol. IUPAC: 7-methyl-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline.
Chemical Property Profile of 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-
Property Insights of 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-. With a topological polar surface area (TPSA) of 30.8 Ų, 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl- has 0 hydrogen bond donor(s) and 3 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 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-?
The CAS number of 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl- is 90832-54-5.
What is the molecular formula of 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-?
The molecular formula of 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl- is C11H11NO2.
What is the molecular weight of 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-?
The molecular weight of 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl- is 189.08 g/mol.
Where can I buy 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-?
You can request a quote for 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolo[4,5-g]isoquinoline, 7,8-dihydro-7-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.