5,8-Epoxyisoquinoline, 5,8-dihydro-
TL;DR: 5,8-Epoxyisoquinoline, 5,8-dihydro- (CAS 40247-40-3) is a chemical compound with molecular formula C9H7NO and molecular weight 145.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-oxa-4-azatricyclo[6.2.1.02,7]undeca-2(7),3,5,9-tetraene
Also Known As: 5,8-Epoxyisoquinoline, 5,8-dihydro-, 5,8-dihydro-5,8-epoxyisoquinoline, 5,8-dihydro-5,8-epoxyisouinoline, 5,8-Epoxy-5,8-dihydroisoquinoline, J1.311.656C
| Molecular Formula | C9H7NO |
|---|---|
| Molecular Weight | 145.05 g/mol |
| LogP | 1.7638 |
| Topological Polar Surface Area | 22.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 145.05276 |
| Heavy Atoms | 11 |
| Complexity | 301.08954 |
Chemical Identifiers
| CAS Number | 40247-40-3 |
|---|---|
| SMILES | C1=CC2C3=C(C1O2)C=CN=C3 |
Product Overview
5,8-Epoxyisoquinoline, 5,8-dihydro- (CAS 40247-40-3), with molecular formula C9H7NO and molecular weight 145.05 g/mol. IUPAC: 11-oxa-4-azatricyclo[6.2.1.02,7]undeca-2(7),3,5,9-tetraene.
Chemical Property Profile of 5,8-Epoxyisoquinoline, 5,8-dihydro-
Property Insights of 5,8-Epoxyisoquinoline, 5,8-dihydro-
The XLogP value of 1.7638 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,8-Epoxyisoquinoline, 5,8-dihydro-. With a topological polar surface area (TPSA) of 22.12 Ų, 5,8-Epoxyisoquinoline, 5,8-dihydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,8-Epoxyisoquinoline, 5,8-dihydro- has 0 hydrogen bond donor(s) and 2 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 5,8-Epoxyisoquinoline, 5,8-dihydro-?
The CAS number of 5,8-Epoxyisoquinoline, 5,8-dihydro- is 40247-40-3.
What is the molecular formula of 5,8-Epoxyisoquinoline, 5,8-dihydro-?
The molecular formula of 5,8-Epoxyisoquinoline, 5,8-dihydro- is C9H7NO.
What is the molecular weight of 5,8-Epoxyisoquinoline, 5,8-dihydro-?
The molecular weight of 5,8-Epoxyisoquinoline, 5,8-dihydro- is 145.05 g/mol.
Where can I buy 5,8-Epoxyisoquinoline, 5,8-dihydro-?
You can request a quote for 5,8-Epoxyisoquinoline, 5,8-dihydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,8-Epoxyisoquinoline, 5,8-dihydro-?
Yes, KEHONG BIO provides custom synthesis services for 5,8-Epoxyisoquinoline, 5,8-dihydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.