CBKinase1_008933
TL;DR: CBKinase1_008933 (CAS 304880-69-1) is a chemical compound with molecular formula C16H18ClN5O3 and molecular weight 363.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-chlorophenyl)methyl]-8-(2-hydroxyethylamino)-3,7-dimethylpurine-2,6-dione
Also Known As: CBKinase1_008933, CBKinase1_021333, BAS 01118276, VU0607818-1, 1-(2-chlorobenzyl)-8-((2-hydroxyethyl)amino)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C16H18ClN5O3 |
|---|---|
| Molecular Weight | 363.11 g/mol |
| LogP | 0.5396 |
| Topological Polar Surface Area | 94.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.1098 |
| Heavy Atoms | 25 |
| Complexity | 1050.3304 |
Chemical Identifiers
| CAS Number | 304880-69-1 |
|---|---|
| SMILES | CN1C2=C(N=C1NCCO)N(C(=O)N(C2=O)CC3=CC=CC=C3Cl)C |
Product Overview
CBKinase1_008933 (CAS 304880-69-1), with molecular formula C16H18ClN5O3 and molecular weight 363.11 g/mol. IUPAC: 1-[(2-chlorophenyl)methyl]-8-(2-hydroxyethylamino)-3,7-dimethylpurine-2,6-dione.
Chemical Property Profile of CBKinase1_008933
Property Insights of CBKinase1_008933
The XLogP value of 0.5396 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_008933. The TPSA of 94.08 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_008933. Following Lipinski's Rule of Five, CBKinase1_008933 has 2 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_008933?
The CAS number of CBKinase1_008933 is 304880-69-1.
What is the molecular formula of CBKinase1_008933?
The molecular formula of CBKinase1_008933 is C16H18ClN5O3.
What is the molecular weight of CBKinase1_008933?
The molecular weight of CBKinase1_008933 is 363.11 g/mol.
Where can I buy CBKinase1_008933?
You can request a quote for CBKinase1_008933 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008933?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008933 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.