![7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile structure](/static/products/847/847185-48-2.png)
7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile
TL;DR: 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile (CAS 847185-48-2) is a chemical compound with molecular formula C24H28N4O2 and molecular weight 404.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,7-dimethyl-2-[(E)-(4-methylpiperazin-1-yl)methylideneamino]-5-oxo-4-phenyl-6,8-dihydro-4H-chromene-3-carbonitrile
Also Known As: 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile, (E)-7,7-dimethyl-2-(((4-methylpiperazin-1-yl)methylene)amino)-5-oxo-4-phenyl-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, 5-keto-7,7-dimethyl-2-[(4-methylpiperazino)methyleneamino]-4-phenyl-6,8-dihydro-4H-chromene-3-carbonitrile, 7,7-dimethyl-2-[(4-methyl-1-piperazinyl)methylideneamino]-5-oxo-4-phenyl-6,8-dihydro-4H-1-benzopyran-3-carbonitrile, 7,7-dimethyl-2-[(4-methylpiperazin-1-yl)methylideneamino]-5-oxidanylidene-4-phenyl-6,8-dihydro-4H-chromene-3-carbonitrile
| Molecular Formula | C24H28N4O2 |
|---|---|
| Molecular Weight | 404.22 g/mol |
| LogP | 3.45448 |
| Topological Polar Surface Area | 68.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.22122 |
| Heavy Atoms | 30 |
| Complexity | 960.6701 |
Chemical Identifiers
| CAS Number | 847185-48-2 |
|---|---|
| SMILES | CC1(CC2=C(C(C(=C(O2)/N=C/N3CCN(CC3)C)C#N)C4=CC=CC=C4)C(=O)C1)C |
Product Overview
7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile (CAS 847185-48-2), with molecular formula C24H28N4O2 and molecular weight 404.22 g/mol. IUPAC: 7,7-dimethyl-2-[(E)-(4-methylpiperazin-1-yl)methylideneamino]-5-oxo-4-phenyl-6,8-dihydro-4H-chromene-3-carbonitrile.
Chemical Property Profile of 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile
Property Insights of 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile
The XLogP value of 3.45448 indicates that 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile. Following Lipinski's Rule of Five, 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile has 0 hydrogen bond donor(s) and 5 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 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile?
The CAS number of 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile is 847185-48-2.
What is the molecular formula of 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile?
The molecular formula of 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile is C24H28N4O2.
What is the molecular weight of 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile?
The molecular weight of 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile is 404.22 g/mol.
Where can I buy 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile?
You can request a quote for 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 7,7-Dimethyl-2-{[1-(4-methyl-piperazin-1-yl)-meth-(E)-ylidene]-amino}-5-oxo-4-phenyl-5,6,7,8-tetrahydr o-4H-chromene-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.