CBKinase1_008101
TL;DR: CBKinase1_008101 (CAS 712338-33-5) is a chemical compound with molecular formula C18H15F3N2OS2 and molecular weight 396.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-ethylphenyl)-2-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]sulfanyl]acetamide
Also Known As: CBKinase1_008101, CBKinase1_020501, AB01251643-03, BRD-K41392452-001-01-8, N-(2-ethylphenyl)-2-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]sulfanyl]acetamide
| Molecular Formula | C18H15F3N2OS2 |
|---|---|
| Molecular Weight | 396.06 g/mol |
| LogP | 5.6083 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.0578 |
| Heavy Atoms | 26 |
| Complexity | 937.57605 |
Chemical Identifiers
| CAS Number | 712338-33-5 |
|---|---|
| SMILES | CCC1=CC=CC=C1NC(=O)CSC2=NC3=C(S2)C=CC(=C3)C(F)(F)F |
Product Overview
CBKinase1_008101 (CAS 712338-33-5), with molecular formula C18H15F3N2OS2 and molecular weight 396.06 g/mol. IUPAC: N-(2-ethylphenyl)-2-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_008101
Property Insights of CBKinase1_008101
The XLogP value of 5.6083 indicates that CBKinase1_008101 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, CBKinase1_008101 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CBKinase1_008101 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_008101?
The CAS number of CBKinase1_008101 is 712338-33-5.
What is the molecular formula of CBKinase1_008101?
The molecular formula of CBKinase1_008101 is C18H15F3N2OS2.
What is the molecular weight of CBKinase1_008101?
The molecular weight of CBKinase1_008101 is 396.06 g/mol.
Where can I buy CBKinase1_008101?
You can request a quote for CBKinase1_008101 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008101?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008101 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.