CBKinase1_006537
TL;DR: CBKinase1_006537 (CAS 706769-99-5) is a chemical compound with molecular formula C29H29NO5 and molecular weight 471.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-3-[2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]indol-2-one
Also Known As: CBKinase1_006537, CBKinase1_018937, BRD-A34531191-001-01-8, 1-(3,4-dimethoxybenzyl)-3-hydroxy-3-[2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]-1,3-dihydro-2H-indol-2-one, 1-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-3-[2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]indol-2-one
| Molecular Formula | C29H29NO5 |
|---|---|
| Molecular Weight | 471.20 g/mol |
| LogP | 4.59 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 471.20456 |
| Heavy Atoms | 35 |
| Complexity | 1299.9796 |
Chemical Identifiers
| CAS Number | 706769-99-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CN2C3=CC=CC=C3C(C2=O)(CC(=O)C4=CC5=C(CCCC5)C=C4)O)OC |
Product Overview
CBKinase1_006537 (CAS 706769-99-5), with molecular formula C29H29NO5 and molecular weight 471.20 g/mol. IUPAC: 1-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-3-[2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]indol-2-one.
Chemical Property Profile of CBKinase1_006537
Property Insights of CBKinase1_006537
The XLogP value of 4.59 indicates that CBKinase1_006537 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_006537. Following Lipinski's Rule of Five, CBKinase1_006537 has 1 hydrogen bond donor(s) and 5 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_006537?
The CAS number of CBKinase1_006537 is 706769-99-5.
What is the molecular formula of CBKinase1_006537?
The molecular formula of CBKinase1_006537 is C29H29NO5.
What is the molecular weight of CBKinase1_006537?
The molecular weight of CBKinase1_006537 is 471.20 g/mol.
Where can I buy CBKinase1_006537?
You can request a quote for CBKinase1_006537 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_006537?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_006537 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.