CBKinase1_003497
TL;DR: CBKinase1_003497 (CAS 457918-77-3) is a chemical compound with molecular formula C23H21N3O3S and molecular weight 419.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-ethylphenyl)-2-[5-(4-methoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetamide
Also Known As: CBKinase1_003497, CBKinase1_015897, AP-906/41640943, BRD-K08168960-001-01-8, N-(2-ethylphenyl)-2-[5-(4-methoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetamide
| Molecular Formula | C23H21N3O3S |
|---|---|
| Molecular Weight | 419.13 g/mol |
| LogP | 4.3347 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 419.13037 |
| Heavy Atoms | 30 |
| Complexity | 1258.92 |
Chemical Identifiers
| CAS Number | 457918-77-3 |
|---|---|
| SMILES | CCC1=CC=CC=C1NC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)OC |
Product Overview
CBKinase1_003497 (CAS 457918-77-3), with molecular formula C23H21N3O3S and molecular weight 419.13 g/mol. IUPAC: N-(2-ethylphenyl)-2-[5-(4-methoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetamide.
Chemical Property Profile of CBKinase1_003497
Property Insights of CBKinase1_003497
The XLogP value of 4.3347 indicates that CBKinase1_003497 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003497. Following Lipinski's Rule of Five, CBKinase1_003497 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_003497?
The CAS number of CBKinase1_003497 is 457918-77-3.
What is the molecular formula of CBKinase1_003497?
The molecular formula of CBKinase1_003497 is C23H21N3O3S.
What is the molecular weight of CBKinase1_003497?
The molecular weight of CBKinase1_003497 is 419.13 g/mol.
Where can I buy CBKinase1_003497?
You can request a quote for CBKinase1_003497 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003497?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003497 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.