CBKinase1_006049
TL;DR: CBKinase1_006049 (CAS 378775-68-9) is a chemical compound with molecular formula C22H18N4O4S2 and molecular weight 466.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-ethyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-nitrophenyl)acetamide
Also Known As: CBKinase1_006049, CBKinase1_018449, 2-((6-ethyl-4-oxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)-N-(4-nitrophenyl)acetamide, BRD-K37397742-001-01-3, F1684-0197
| Molecular Formula | C22H18N4O4S2 |
|---|---|
| Molecular Weight | 466.08 g/mol |
| LogP | 4.6486 |
| Topological Polar Surface Area | 107.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 466.07693 |
| Heavy Atoms | 32 |
| Complexity | 1348.3711 |
Chemical Identifiers
| CAS Number | 378775-68-9 |
|---|---|
| SMILES | CCC1=CC2=C(S1)N=C(N(C2=O)C3=CC=CC=C3)SCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
CBKinase1_006049 (CAS 378775-68-9), with molecular formula C22H18N4O4S2 and molecular weight 466.08 g/mol. IUPAC: 2-(6-ethyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-nitrophenyl)acetamide.
Chemical Property Profile of CBKinase1_006049
Property Insights of CBKinase1_006049
The XLogP value of 4.6486 indicates that CBKinase1_006049 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.13 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_006049. Following Lipinski's Rule of Five, CBKinase1_006049 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_006049?
The CAS number of CBKinase1_006049 is 378775-68-9.
What is the molecular formula of CBKinase1_006049?
The molecular formula of CBKinase1_006049 is C22H18N4O4S2.
What is the molecular weight of CBKinase1_006049?
The molecular weight of CBKinase1_006049 is 466.08 g/mol.
Where can I buy CBKinase1_006049?
You can request a quote for CBKinase1_006049 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_006049?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_006049 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.