2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile
TL;DR: 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile (CAS 1164538-70-8) is a chemical compound with molecular formula C18H11NO2 and molecular weight 273.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-benzylidene-2-oxo-4-phenylfuran-3-carbonitrile
Also Known As: 2-oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile, (5Z)-5-benzylidene-2-oxo-4-phenylfuran-3-carbonitrile, (5Z)-2-oxo-4-phenyl-5-(phenylmethylidene)-2,5-dihydrofuran-3-carbonitrile, (5Z)-5-benzal-2-keto-4-phenyl-3-furonitrile, (5Z)-5-benzylidene-2-oxo-4-phenyl-furan-3-carbonitrile
| Molecular Formula | C18H11NO2 |
|---|---|
| Molecular Weight | 273.08 g/mol |
| LogP | 3.56168 |
| Topological Polar Surface Area | 50.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.07898 |
| Heavy Atoms | 21 |
| Complexity | 780.97296 |
Chemical Identifiers
| CAS Number | 1164538-70-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C\2/C(=C(C(=O)O2)C#N)C3=CC=CC=C3 |
Product Overview
2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile (CAS 1164538-70-8), with molecular formula C18H11NO2 and molecular weight 273.08 g/mol. IUPAC: (5Z)-5-benzylidene-2-oxo-4-phenylfuran-3-carbonitrile.
Chemical Property Profile of 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile
Property Insights of 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile
The XLogP value of 3.56168 indicates that 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.09 Ų, 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile has 0 hydrogen bond donor(s) and 3 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-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile?
The CAS number of 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile is 1164538-70-8.
What is the molecular formula of 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile?
The molecular formula of 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile is C18H11NO2.
What is the molecular weight of 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile?
The molecular weight of 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile is 273.08 g/mol.
Where can I buy 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile?
You can request a quote for 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-4-phenyl-5-(phenylmethylene)-2,5-dihydro-3-furancarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.