CBKinase1_009298
TL;DR: CBKinase1_009298 (CAS 573944-03-3) is a chemical compound with molecular formula C21H21N5O2S3 and molecular weight 471.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethoxyphenyl)-2-[(7-methylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.6.0.02,6.011,15]pentadeca-1(9),2,4,7,11(15)-pentaen-5-yl)sulfanyl]acetamide
Also Known As: CBKinase1_009298, CBKinase1_021698, BRD-K72697847-001-01-6, N-(4-ethoxyphenyl)-2-((5-(methylthio)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)acetamide, N-(4-ethoxyphenyl)-2-{[5-(methylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
| Molecular Formula | C21H21N5O2S3 |
|---|---|
| Molecular Weight | 471.09 g/mol |
| LogP | 4.6791 |
| Topological Polar Surface Area | 81.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 471.08572 |
| Heavy Atoms | 31 |
| Complexity | 1265.9823 |
Chemical Identifiers
| CAS Number | 573944-03-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C3N2C(=NC4=C3C5=C(S4)CCC5)SC |
Product Overview
CBKinase1_009298 (CAS 573944-03-3), with molecular formula C21H21N5O2S3 and molecular weight 471.09 g/mol. IUPAC: N-(4-ethoxyphenyl)-2-[(7-methylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.6.0.02,6.011,15]pentadeca-1(9),2,4,7,11(15)-pentaen-5-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_009298
Property Insights of CBKinase1_009298
The XLogP value of 4.6791 indicates that CBKinase1_009298 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.41 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_009298. Following Lipinski's Rule of Five, CBKinase1_009298 has 1 hydrogen bond donor(s) and 8 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_009298?
The CAS number of CBKinase1_009298 is 573944-03-3.
What is the molecular formula of CBKinase1_009298?
The molecular formula of CBKinase1_009298 is C21H21N5O2S3.
What is the molecular weight of CBKinase1_009298?
The molecular weight of CBKinase1_009298 is 471.09 g/mol.
Where can I buy CBKinase1_009298?
You can request a quote for CBKinase1_009298 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_009298?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_009298 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.