2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione
TL;DR: 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione (CAS 7478-98-0) is a chemical compound with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyridin-2-yl-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione
Also Known As: 2-pyridyl[?]dione, BIM-0004871.P001, 2-(pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione, 4-(2-pyridinyl)-10-oxa-4-azatricyclo[5.2.1.0~2,6~]decane-3,5-dione, 2-Pyridin-2-ylhexahydro-1H-4,7-epoxyisoindole-1,3-dione
| Molecular Formula | C13H12N2O3 |
|---|---|
| Molecular Weight | 244.08 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 59.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.0848 |
| Heavy Atoms | 18 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 7478-98-0 |
|---|---|
| SMILES | C1CC2C3C(C1O2)C(=O)N(C3=O)C4=CC=CC=N4 |
| InChIKey | XUXGTVRRRQGACS-UHFFFAOYSA-N |
Product Overview
2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione (CAS 7478-98-0), with molecular formula C13H12N2O3 and molecular weight 244.08 g/mol. IUPAC: 2-pyridin-2-yl-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione.
Chemical Property Profile of 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione
Property Insights of 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione. With a topological polar surface area (TPSA) of 59.5 Ų, 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione has 0 hydrogen bond donor(s) and 4 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 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione?
The CAS number of 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione is 7478-98-0.
What is the molecular formula of 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione?
The molecular formula of 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione is C13H12N2O3.
What is the molecular weight of 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione?
The molecular weight of 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione is 244.08 g/mol.
Where can I buy 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione?
You can request a quote for 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(Pyridin-2-yl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.