CBKinase1_002854
TL;DR: CBKinase1_002854 (CAS 393784-78-6) is a chemical compound with molecular formula C18H19ClN6O and molecular weight 370.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-[[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]propyl]pyrrolidin-2-one
Also Known As: CBKinase1_002854, CBKinase1_015254, BRD-K54805392-001-01-6, 1-[3-[[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]propyl]pyrrolidin-2-one, 1-(3-((1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino)propyl)pyrrolidin-2-one
| Molecular Formula | C18H19ClN6O |
|---|---|
| Molecular Weight | 370.13 g/mol |
| LogP | 2.8933 |
| Topological Polar Surface Area | 75.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 370.1309 |
| Heavy Atoms | 26 |
| Complexity | 923.08093 |
Chemical Identifiers
| CAS Number | 393784-78-6 |
|---|---|
| SMILES | C1CC(=O)N(C1)CCCNC2=C3C=NN(C3=NC=N2)C4=CC=C(C=C4)Cl |
Product Overview
CBKinase1_002854 (CAS 393784-78-6), with molecular formula C18H19ClN6O and molecular weight 370.13 g/mol. IUPAC: 1-[3-[[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]propyl]pyrrolidin-2-one.
Chemical Property Profile of CBKinase1_002854
Property Insights of CBKinase1_002854
The XLogP value of 2.8933 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_002854. The TPSA of 75.94 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_002854. Following Lipinski's Rule of Five, CBKinase1_002854 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_002854?
The CAS number of CBKinase1_002854 is 393784-78-6.
What is the molecular formula of CBKinase1_002854?
The molecular formula of CBKinase1_002854 is C18H19ClN6O.
What is the molecular weight of CBKinase1_002854?
The molecular weight of CBKinase1_002854 is 370.13 g/mol.
Where can I buy CBKinase1_002854?
You can request a quote for CBKinase1_002854 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002854?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002854 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.