![4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile structure](/static/products/878/878984-33-9.png)
4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile
TL;DR: 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile (CAS 878984-33-9) is a chemical compound with molecular formula C22H20N2O3 and molecular weight 360.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile
Also Known As: 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile, 4-[3-hydroxy-2-oxo-3-(2-oxo-4-phenyl-3-butenyl)-2,3-dihydro-1H-indol-1-yl]butanenitrile, 4-{3-hydroxy-2-oxo-3-[(3E)-2-oxo-4-phenylbut-3-en-1-yl]-2,3-dihydro-1H-indol-1-yl}butanenitrile, (E)-4-(3-hydroxy-2-oxo-3-(2-oxo-4-phenylbut-3-en-1-yl)indolin-1-yl)butanenitrile
| Molecular Formula | C22H20N2O3 |
|---|---|
| Molecular Weight | 360.15 g/mol |
| LogP | 3.19718 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 360.1474 |
| Heavy Atoms | 27 |
| Complexity | 914.65515 |
Chemical Identifiers
| CAS Number | 878984-33-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C(=O)CC2(C3=CC=CC=C3N(C2=O)CCCC#N)O |
Product Overview
4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile (CAS 878984-33-9), with molecular formula C22H20N2O3 and molecular weight 360.15 g/mol. IUPAC: 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile.
Chemical Property Profile of 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile
Property Insights of 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile
The XLogP value of 3.19718 indicates that 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile. Following Lipinski's Rule of Five, 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile has 1 hydrogen bond donor(s) and 4 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 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile?
The CAS number of 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile is 878984-33-9.
What is the molecular formula of 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile?
The molecular formula of 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile is C22H20N2O3.
What is the molecular weight of 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile?
The molecular weight of 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile is 360.15 g/mol.
Where can I buy 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile?
You can request a quote for 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-hydroxy-2-oxo-3-[(E)-2-oxo-4-phenylbut-3-enyl]indol-1-yl]butanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.