CBKinase1_001626
TL;DR: CBKinase1_001626 (CAS 433697-61-1) is a chemical compound with molecular formula C19H19N3O5S and molecular weight 401.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[2-(4-methoxyanilino)-2-oxoethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate
Also Known As: CBKinase1_001626, CBKinase1_014026, BAS 03754244, BRD-K96128455-001-01-7, ethyl 3-(2-((4-methoxyphenyl)amino)-2-oxoethyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
| Molecular Formula | C19H19N3O5S |
|---|---|
| Molecular Weight | 401.10 g/mol |
| LogP | 2.59042 |
| Topological Polar Surface Area | 99.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.10455 |
| Heavy Atoms | 28 |
| Complexity | 1085.3824 |
Chemical Identifiers
| CAS Number | 433697-61-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC(=O)NC3=CC=C(C=C3)OC)C |
Product Overview
CBKinase1_001626 (CAS 433697-61-1), with molecular formula C19H19N3O5S and molecular weight 401.10 g/mol. IUPAC: ethyl 3-[2-(4-methoxyanilino)-2-oxoethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate.
Chemical Property Profile of CBKinase1_001626
Property Insights of CBKinase1_001626
The XLogP value of 2.59042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_001626. The TPSA of 99.52 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_001626. Following Lipinski's Rule of Five, CBKinase1_001626 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_001626?
The CAS number of CBKinase1_001626 is 433697-61-1.
What is the molecular formula of CBKinase1_001626?
The molecular formula of CBKinase1_001626 is C19H19N3O5S.
What is the molecular weight of CBKinase1_001626?
The molecular weight of CBKinase1_001626 is 401.10 g/mol.
Where can I buy CBKinase1_001626?
You can request a quote for CBKinase1_001626 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_001626?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_001626 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.