![1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile structure](/static/products/116/1164539-17-6.png)
1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile
TL;DR: 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile (CAS 1164539-17-6) is a chemical compound with molecular formula C28H24N2O3 and molecular weight 436.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,2-dimethylpropanoyl)-1',3'-dioxo-2-phenylspiro[3,8a-dihydro-2H-indolizine-1,2'-indene]-6-carbonitrile
Also Known As: 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile, 3'-(2,2-dimethylpropanoyl)-1,3-dioxo-2'-phenyl-1,2',3,3'-tetrahydro-8a'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile, 3-(2,2-dimethylpropanoyl)-1',3'-dioxo-2-phenylspiro[3,8a-dihydro-2H-indolizine-1,2'-indene]-6-carbonitrile
| Molecular Formula | C28H24N2O3 |
|---|---|
| Molecular Weight | 436.18 g/mol |
| LogP | 4.48108 |
| Topological Polar Surface Area | 78.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 436.17868 |
| Heavy Atoms | 33 |
| Complexity | 1255.4128 |
Chemical Identifiers
| CAS Number | 1164539-17-6 |
|---|---|
| SMILES | CC(C)(C)C(=O)C1C(C2(C3N1C=C(C=C3)C#N)C(=O)C4=CC=CC=C4C2=O)C5=CC=CC=C5 |
Product Overview
1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile (CAS 1164539-17-6), with molecular formula C28H24N2O3 and molecular weight 436.18 g/mol. IUPAC: 3-(2,2-dimethylpropanoyl)-1',3'-dioxo-2-phenylspiro[3,8a-dihydro-2H-indolizine-1,2'-indene]-6-carbonitrile.
Chemical Property Profile of 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile
Property Insights of 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile
The XLogP value of 4.48108 indicates that 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile. Following Lipinski's Rule of Five, 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-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 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile?
The CAS number of 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile is 1164539-17-6.
What is the molecular formula of 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile?
The molecular formula of 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile is C28H24N2O3.
What is the molecular weight of 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile?
The molecular weight of 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile is 436.18 g/mol.
Where can I buy 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile?
You can request a quote for 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1,3-dioxo-2'-phenyl-3'-pivaloyl-1,3,3',8a'-tetrahydro-2'H-spiro[indene-2,1'-indolizine]-6'-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.