CBKinase1_011505
TL;DR: CBKinase1_011505 (CAS 696614-33-2) is a chemical compound with molecular formula C20H24FN5O3S and molecular weight 433.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-2-[7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxopurin-8-yl]sulfanylacetamide
Also Known As: CBKinase1_011505, CBKinase1_023905, BAS 09688750, AB01291214-01, BRD-K81137915-001-01-9
| Molecular Formula | C20H24FN5O3S |
|---|---|
| Molecular Weight | 433.16 g/mol |
| LogP | 1.6279 |
| Topological Polar Surface Area | 90.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 433.1584 |
| Heavy Atoms | 30 |
| Complexity | 1236.1836 |
Chemical Identifiers
| CAS Number | 696614-33-2 |
|---|---|
| SMILES | CC(C)(C)NC(=O)CSC1=NC2=C(N1CC3=CC=CC=C3F)C(=O)N(C(=O)N2C)C |
Product Overview
CBKinase1_011505 (CAS 696614-33-2), with molecular formula C20H24FN5O3S and molecular weight 433.16 g/mol. IUPAC: N-tert-butyl-2-[7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxopurin-8-yl]sulfanylacetamide.
Chemical Property Profile of CBKinase1_011505
Property Insights of CBKinase1_011505
The XLogP value of 1.6279 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_011505. The TPSA of 90.92 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_011505. Following Lipinski's Rule of Five, CBKinase1_011505 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_011505?
The CAS number of CBKinase1_011505 is 696614-33-2.
What is the molecular formula of CBKinase1_011505?
The molecular formula of CBKinase1_011505 is C20H24FN5O3S.
What is the molecular weight of CBKinase1_011505?
The molecular weight of CBKinase1_011505 is 433.16 g/mol.
Where can I buy CBKinase1_011505?
You can request a quote for CBKinase1_011505 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_011505?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_011505 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.