CBKinase1_005286
TL;DR: CBKinase1_005286 (CAS 454666-15-0) is a chemical compound with molecular formula C17H13ClN2O3S2 and molecular weight 392.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Also Known As: CBKinase1_005286, CBKinase1_017686, BRD-K88711287-001-01-4, 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide, 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
| Molecular Formula | C17H13ClN2O3S2 |
|---|---|
| Molecular Weight | 392.01 g/mol |
| LogP | 4.4517 |
| Topological Polar Surface Area | 60.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.0056 |
| Heavy Atoms | 25 |
| Complexity | 944.7877 |
Chemical Identifiers
| CAS Number | 454666-15-0 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NC4=C(S3)C=CC(=C4)Cl |
Product Overview
CBKinase1_005286 (CAS 454666-15-0), with molecular formula C17H13ClN2O3S2 and molecular weight 392.01 g/mol. IUPAC: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide.
Chemical Property Profile of CBKinase1_005286
Property Insights of CBKinase1_005286
The XLogP value of 4.4517 indicates that CBKinase1_005286 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.45 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_005286. Following Lipinski's Rule of Five, CBKinase1_005286 has 1 hydrogen bond donor(s) and 6 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_005286?
The CAS number of CBKinase1_005286 is 454666-15-0.
What is the molecular formula of CBKinase1_005286?
The molecular formula of CBKinase1_005286 is C17H13ClN2O3S2.
What is the molecular weight of CBKinase1_005286?
The molecular weight of CBKinase1_005286 is 392.01 g/mol.
Where can I buy CBKinase1_005286?
You can request a quote for CBKinase1_005286 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_005286?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_005286 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.