![{phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile structure](/static/products/384/384348-75-8.png)
{phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile
TL;DR: {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile (CAS 384348-75-8) is a chemical compound with molecular formula C35H25N3O and molecular weight 503.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-benzoyl-2-phenyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl)-phenylmethylidene]propanedinitrile
Also Known As: {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile, 2-((3-benzoyl-2-phenyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl)(phenyl)methylene)malononitrile, 2-[(3-benzoyl-2-phenyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl)-phenylmethylidene]propanedinitrile
| Molecular Formula | C35H25N3O |
|---|---|
| Molecular Weight | 503.20 g/mol |
| LogP | 7.18006 |
| Topological Polar Surface Area | 67.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 503.19977 |
| Heavy Atoms | 39 |
| Complexity | 1643.9922 |
Chemical Identifiers
| CAS Number | 384348-75-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C(C3C4=CC=CC=C4C=CN3C2C(=O)C5=CC=CC=C5)C(=C(C#N)C#N)C6=CC=CC=C6 |
Product Overview
{phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile (CAS 384348-75-8), with molecular formula C35H25N3O and molecular weight 503.20 g/mol. IUPAC: 2-[(3-benzoyl-2-phenyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl)-phenylmethylidene]propanedinitrile.
Chemical Property Profile of {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile
Property Insights of {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile
The XLogP value of 7.18006 indicates that {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.89 Ų falls within the moderate polarity range, balancing permeability and solubility for {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile. Following Lipinski's Rule of Five, {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile?
The CAS number of {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile is 384348-75-8.
What is the molecular formula of {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile?
The molecular formula of {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile is C35H25N3O.
What is the molecular weight of {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile?
The molecular weight of {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile is 503.20 g/mol.
Where can I buy {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile?
You can request a quote for {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for {phenyl[2-phenyl-3-(phenylcarbonyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinolin-1-yl]methylidene}propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.