CBKinase1_010306
TL;DR: CBKinase1_010306 (CAS 736957-03-2) is a chemical compound with molecular formula C18H18N2O4S2 and molecular weight 390.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate
Also Known As: CBKinase1_010306, CBKinase1_022706, AP-853/42935666, BRD-K26894141-001-01-9, ethyl 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate
| Molecular Formula | C18H18N2O4S2 |
|---|---|
| Molecular Weight | 390.07 g/mol |
| LogP | 4.41364 |
| Topological Polar Surface Area | 81.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.0708 |
| Heavy Atoms | 26 |
| Complexity | 928.411 |
Chemical Identifiers
| CAS Number | 736957-03-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NC3=CC=CC=C3O2 |
Product Overview
CBKinase1_010306 (CAS 736957-03-2), with molecular formula C18H18N2O4S2 and molecular weight 390.07 g/mol. IUPAC: ethyl 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate.
Chemical Property Profile of CBKinase1_010306
Property Insights of CBKinase1_010306
The XLogP value of 4.41364 indicates that CBKinase1_010306 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.43 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_010306. Following Lipinski's Rule of Five, CBKinase1_010306 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_010306?
The CAS number of CBKinase1_010306 is 736957-03-2.
What is the molecular formula of CBKinase1_010306?
The molecular formula of CBKinase1_010306 is C18H18N2O4S2.
What is the molecular weight of CBKinase1_010306?
The molecular weight of CBKinase1_010306 is 390.07 g/mol.
Where can I buy CBKinase1_010306?
You can request a quote for CBKinase1_010306 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_010306?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_010306 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.