2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile
TL;DR: 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile (CAS 78563-60-7) is a chemical compound with molecular formula C16H10N4O and molecular weight 274.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-(furan-2-yl)-1-phenylpyrrole-3,4-dicarbonitrile
Also Known As: 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile, NCI60_029256, 2-amino-5-(furan-2-yl)-1-phenylpyrrole-3,4-dicarbonitrile, 1H-Pyrrole-3,4-dicarbonitrile, 2-amino-5-(2-furanyl)-1-phenyl-, 2-amino-5-(2-furyl)-1-phenyl-pyrrole-3,4-dicarbonitrile
| Molecular Formula | C16H10N4O |
|---|---|
| Molecular Weight | 274.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 91.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.08545 |
| Heavy Atoms | 21 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 78563-60-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=C(C(=C2N)C#N)C#N)C3=CC=CO3 |
| InChIKey | XOZGFVVIJIHNCC-UHFFFAOYSA-N |
Product Overview
2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile (CAS 78563-60-7), with molecular formula C16H10N4O and molecular weight 274.09 g/mol. IUPAC: 2-amino-5-(furan-2-yl)-1-phenylpyrrole-3,4-dicarbonitrile.
Chemical Property Profile of 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile
Property Insights of 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile. Following Lipinski's Rule of Five, 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile has 1 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-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile?
The CAS number of 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile is 78563-60-7.
What is the molecular formula of 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile?
The molecular formula of 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile is C16H10N4O.
What is the molecular weight of 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile?
The molecular weight of 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile is 274.09 g/mol.
Where can I buy 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile?
You can request a quote for 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-5-(furan-2-yl)-1-phenyl-1H-pyrrole-3,4-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.