CBKinase1_008712
TL;DR: CBKinase1_008712 (CAS 677735-74-9) is a chemical compound with molecular formula C17H14BrF2N3O2S2 and molecular weight 472.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromo-4,6-difluorophenyl)-2-(3,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide
Also Known As: CBKinase1_008712, CBKinase1_021112, BRD-K63408686-001-01-3, N-(2-bromo-4,6-difluorophenyl)-2-[(3,5,6-trimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide, N-(2-bromo-4,6-difluorophenyl)-2-((3,5,6-trimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)acetamide
| Molecular Formula | C17H14BrF2N3O2S2 |
|---|---|
| Molecular Weight | 472.97 g/mol |
| LogP | 4.38334 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 472.9679 |
| Heavy Atoms | 27 |
| Complexity | 1104.5397 |
Chemical Identifiers
| CAS Number | 677735-74-9 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=C(C=C(C=C3Br)F)F)C)C |
Product Overview
CBKinase1_008712 (CAS 677735-74-9), with molecular formula C17H14BrF2N3O2S2 and molecular weight 472.97 g/mol. IUPAC: N-(2-bromo-4,6-difluorophenyl)-2-(3,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide.
Chemical Property Profile of CBKinase1_008712
Property Insights of CBKinase1_008712
The XLogP value of 4.38334 indicates that CBKinase1_008712 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_008712. Following Lipinski's Rule of Five, CBKinase1_008712 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_008712?
The CAS number of CBKinase1_008712 is 677735-74-9.
What is the molecular formula of CBKinase1_008712?
The molecular formula of CBKinase1_008712 is C17H14BrF2N3O2S2.
What is the molecular weight of CBKinase1_008712?
The molecular weight of CBKinase1_008712 is 472.97 g/mol.
Where can I buy CBKinase1_008712?
You can request a quote for CBKinase1_008712 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008712?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008712 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.