![{4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile structure](/static/products/314/314729-71-0.png)
{4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile
TL;DR: {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile (CAS 314729-71-0) is a chemical compound with molecular formula C30H29N3O2 and molecular weight 463.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-benzoyl-4-[(dimethylamino)methyl]-5-oxo-3,5-diphenylpentyl]propanedinitrile
Also Known As: {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile, 2-(2-benzoyl-4-((dimethylamino)methyl)-5-oxo-3,5-diphenylpentyl)malononitrile, 2-[2-benzoyl-4-(dimethylaminomethyl)-5-oxo-3,5-diphenyl-pentyl]propanedinitrile, 2-[2-benzoyl-4-(dimethylaminomethyl)-5-oxo-3,5-diphenylpentyl]propanedinitrile
| Molecular Formula | C30H29N3O2 |
|---|---|
| Molecular Weight | 463.23 g/mol |
| LogP | 5.38346 |
| Topological Polar Surface Area | 84.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 463.22598 |
| Heavy Atoms | 35 |
| Complexity | 1181.104 |
Chemical Identifiers
| CAS Number | 314729-71-0 |
|---|---|
| SMILES | CN(C)CC(C(C1=CC=CC=C1)C(CC(C#N)C#N)C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3 |
Product Overview
{4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile (CAS 314729-71-0), with molecular formula C30H29N3O2 and molecular weight 463.23 g/mol. IUPAC: 2-[2-benzoyl-4-[(dimethylamino)methyl]-5-oxo-3,5-diphenylpentyl]propanedinitrile.
Chemical Property Profile of {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile
Property Insights of {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile
The XLogP value of 5.38346 indicates that {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.96 Ų falls within the moderate polarity range, balancing permeability and solubility for {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile. Following Lipinski's Rule of Five, {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile?
The CAS number of {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile is 314729-71-0.
What is the molecular formula of {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile?
The molecular formula of {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile is C30H29N3O2.
What is the molecular weight of {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile?
The molecular weight of {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile is 463.23 g/mol.
Where can I buy {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile?
You can request a quote for {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for {4-[(dimethylamino)methyl]-5-oxo-3,5-diphenyl-2-(phenylcarbonyl)pentyl}propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.