BAS 04819255
TL;DR: BAS 04819255 (CAS 442653-93-2) is a chemical compound with molecular formula C20H18N2O3 and molecular weight 334.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-hydroxy-2-oxo-3-phenacylindol-1-yl)butanenitrile
Also Known As: BAS 04819255, 4-(3-hydroxy-2-oxo-3-phenacylindol-1-yl)butanenitrile, 4-[3-hydroxy-2-oxo-3-(2-oxo-2-phenylethyl)-2,3-dihydro-1H-indol-1-yl]butanenitrile, 4-[3-hydroxy-2-oxo-3-(2-oxo-2-phenylethyl)indolinyl]butanenitrile
| Molecular Formula | C20H18N2O3 |
|---|---|
| Molecular Weight | 334.13 g/mol |
| LogP | 2.79758 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.13174 |
| Heavy Atoms | 25 |
| Complexity | 841.51984 |
Chemical Identifiers
| CAS Number | 442653-93-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CC2(C3=CC=CC=C3N(C2=O)CCCC#N)O |
Product Overview
BAS 04819255 (CAS 442653-93-2), with molecular formula C20H18N2O3 and molecular weight 334.13 g/mol. IUPAC: 4-(3-hydroxy-2-oxo-3-phenacylindol-1-yl)butanenitrile.
Chemical Property Profile of BAS 04819255
Property Insights of BAS 04819255
The XLogP value of 2.79758 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04819255. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04819255. Following Lipinski's Rule of Five, BAS 04819255 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 BAS 04819255?
The CAS number of BAS 04819255 is 442653-93-2.
What is the molecular formula of BAS 04819255?
The molecular formula of BAS 04819255 is C20H18N2O3.
What is the molecular weight of BAS 04819255?
The molecular weight of BAS 04819255 is 334.13 g/mol.
Where can I buy BAS 04819255?
You can request a quote for BAS 04819255 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04819255?
Yes, KEHONG BIO provides custom synthesis services for BAS 04819255 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.