(E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile
TL;DR: (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile (CAS 142682-96-0) is a chemical compound with molecular formula C12H8N4O2 and molecular weight 240.06473 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(E)-furan-2-ylmethylideneamino]-5-methoxy-1H-pyrrole-3,4-dicarbonitrile
Also Known As: (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile
Technical Specifications
| Molecular Formula | C12H8N4O2 |
| Molecular Weight | 240.06473 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 98.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.06473 Da |
| Heavy Atoms | 18 |
| Complexity | 418.0 |
| SMILES | COC1=C(C(=C(N1)/N=C/C2=CC=CO2)C#N)C#N |
| InChIKey | KQZHVRIEHQHBCL-VIZOYTHASA-N |
Chemical Property Profile of (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile
Property Insights of (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile. The TPSA of 98.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile. Following Lipinski's Rule of Five, (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile?
The CAS number of (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile is 142682-96-0.
What is the molecular formula of (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile?
The molecular formula of (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile is C12H8N4O2.
What is the molecular weight of (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile?
The molecular weight of (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile is 240.06473 g/mol.
Where can I buy (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile?
You can request a quote for (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile?
Yes, CoreyChem provides custom synthesis services for (E)-2-((furan-2-ylmethylene)amino)-5-methoxy-1H-pyrrole-3,4-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.