3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile
TL;DR: 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile (CAS 77198-57-3) is a chemical compound with molecular formula C18H11N3O and molecular weight 285.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(furan-2-yl)-6-phenylbenzene-1,3-dicarbonitrile
Also Known As: 3-amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile, BAS 13070166, 3-Amino-5-furan-2-yl-biphenyl-2,4-dicarbonitrile, 1,1'-Biphenyl-2,4-dicarbonitrile, 3-amino-5-(2-furyl)-, 2-amino-6-(2-furyl)-4-phenylbenzene-1,3-dicarbonitrile
| Molecular Formula | C18H11N3O |
|---|---|
| Molecular Weight | 285.09 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.0902 |
| Heavy Atoms | 22 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 77198-57-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=C(C(=C2C#N)N)C#N)C3=CC=CO3 |
| InChIKey | SLQVQKSDEBBOSA-UHFFFAOYSA-N |
Product Overview
3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile (CAS 77198-57-3), with molecular formula C18H11N3O and molecular weight 285.09 g/mol. IUPAC: 2-amino-4-(furan-2-yl)-6-phenylbenzene-1,3-dicarbonitrile.
Chemical Property Profile of 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile
Property Insights of 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile
The XLogP value of 3.6 indicates that 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile. Following Lipinski's Rule of Five, 3-Amino-5-(furan-2-yl)biphenyl-2,4-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 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile?
The CAS number of 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile is 77198-57-3.
What is the molecular formula of 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile?
The molecular formula of 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile is C18H11N3O.
What is the molecular weight of 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile?
The molecular weight of 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile is 285.09 g/mol.
Where can I buy 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile?
You can request a quote for 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-5-(furan-2-yl)biphenyl-2,4-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.