CBKinase1_008984
TL;DR: CBKinase1_008984 (CAS 677346-14-4) is a chemical compound with molecular formula C20H21N3O4S2 and molecular weight 431.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-ethyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide
Also Known As: CBKinase1_008984, CBKinase1_021384, BRD-K82560212-001-01-1, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-ethyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide, N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-((3-ethyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)acetamide
| Molecular Formula | C20H21N3O4S2 |
|---|---|
| Molecular Weight | 431.10 g/mol |
| LogP | 3.59674 |
| Topological Polar Surface Area | 82.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.09735 |
| Heavy Atoms | 29 |
| Complexity | 1152.8143 |
Chemical Identifiers
| CAS Number | 677346-14-4 |
|---|---|
| SMILES | CCN1C(=O)C2=C(N=C1SCC(=O)NC3=CC4=C(C=C3)OCCO4)SC(=C2C)C |
Product Overview
CBKinase1_008984 (CAS 677346-14-4), with molecular formula C20H21N3O4S2 and molecular weight 431.10 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-ethyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide.
Chemical Property Profile of CBKinase1_008984
Property Insights of CBKinase1_008984
The XLogP value of 3.59674 indicates that CBKinase1_008984 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.45 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_008984. Following Lipinski's Rule of Five, CBKinase1_008984 has 1 hydrogen bond donor(s) and 7 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_008984?
The CAS number of CBKinase1_008984 is 677346-14-4.
What is the molecular formula of CBKinase1_008984?
The molecular formula of CBKinase1_008984 is C20H21N3O4S2.
What is the molecular weight of CBKinase1_008984?
The molecular weight of CBKinase1_008984 is 431.10 g/mol.
Where can I buy CBKinase1_008984?
You can request a quote for CBKinase1_008984 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008984?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008984 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.