Hydrohydrastinine
TL;DR: Hydrohydrastinine (CAS 494-55-3) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline
Also Known As: Hydrohydrastinine, Hydrohydrastinin, 6-Methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline, HYDROHYDRASTININE [MI], Norhydrastinine,2-dihydro-2-methyl-
| Molecular Formula | C11H13NO2 |
|---|---|
| Molecular Weight | 191.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 191.09464 |
| Heavy Atoms | 14 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 494-55-3 |
|---|---|
| SMILES | CN1CCC2=CC3=C(C=C2C1)OCO3 |
| InChIKey | XNZFFRJWTVYMBF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hydrohydrastinine (CAS 494-55-3), with molecular formula C11H13NO2 and molecular weight 191.09 g/mol. IUPAC: 6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline.
Chemical Property Profile of Hydrohydrastinine
Property Insights of Hydrohydrastinine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydrohydrastinine. With a topological polar surface area (TPSA) of 21.7 Ų, Hydrohydrastinine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydrohydrastinine 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 Hydrohydrastinine?
The CAS number of Hydrohydrastinine is 494-55-3.
What is the molecular formula of Hydrohydrastinine?
The molecular formula of Hydrohydrastinine is C11H13NO2.
What is the molecular weight of Hydrohydrastinine?
The molecular weight of Hydrohydrastinine is 191.09 g/mol.
Where can I buy Hydrohydrastinine?
You can request a quote for Hydrohydrastinine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydrohydrastinine?
Yes, KEHONG BIO provides custom synthesis services for Hydrohydrastinine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.