CBKinase1_011580
TL;DR: CBKinase1_011580 (CAS 690227-54-4) is a chemical compound with molecular formula C22H16Cl2N2O3 and molecular weight 426.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-1-[(2-chlorophenyl)methyl]-3-hydroxy-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one
Also Known As: CBKinase1_011580, CBKinase1_023980, A3926/0167060, 5-chloro-1-[(2-chlorophenyl)methyl]-3-hydroxy-3-[2-oxo-2-(pyridin-4-yl)ethyl]-2,3-dihydro-1H-indol-2-one, 5-chloro-1-[(2-chlorophenyl)methyl]-3-hydroxy-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one
| Molecular Formula | C22H16Cl2N2O3 |
|---|---|
| Molecular Weight | 426.05 g/mol |
| LogP | 4.3958 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 426.0538 |
| Heavy Atoms | 29 |
| Complexity | 1104.2213 |
Chemical Identifiers
| CAS Number | 690227-54-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN2C3=C(C=C(C=C3)Cl)C(C2=O)(CC(=O)C4=CC=NC=C4)O)Cl |
Product Overview
CBKinase1_011580 (CAS 690227-54-4), with molecular formula C22H16Cl2N2O3 and molecular weight 426.05 g/mol. IUPAC: 5-chloro-1-[(2-chlorophenyl)methyl]-3-hydroxy-3-(2-oxo-2-pyridin-4-ylethyl)indol-2-one.
Chemical Property Profile of CBKinase1_011580
Property Insights of CBKinase1_011580
The XLogP value of 4.3958 indicates that CBKinase1_011580 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_011580. Following Lipinski's Rule of Five, CBKinase1_011580 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 CBKinase1_011580?
The CAS number of CBKinase1_011580 is 690227-54-4.
What is the molecular formula of CBKinase1_011580?
The molecular formula of CBKinase1_011580 is C22H16Cl2N2O3.
What is the molecular weight of CBKinase1_011580?
The molecular weight of CBKinase1_011580 is 426.05 g/mol.
Where can I buy CBKinase1_011580?
You can request a quote for CBKinase1_011580 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_011580?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_011580 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.