CBKinase1_004309
TL;DR: CBKinase1_004309 (CAS 694472-84-9) is a chemical compound with molecular formula C17H12Cl3N3O2S and molecular weight 426.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2,4,6-trichlorophenyl)acetamide
Also Known As: CBKinase1_004309, CBKinase1_016709, BRD-K71662124-001-01-5, 2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2,4,6-trichlorophenyl)acetamide, 2-{[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(2,4,6-trichlorophenyl)acetamide
| Molecular Formula | C17H12Cl3N3O2S |
|---|---|
| Molecular Weight | 426.97 g/mol |
| LogP | 5.73602 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 426.9716 |
| Heavy Atoms | 26 |
| Complexity | 938.9262 |
Chemical Identifiers
| CAS Number | 694472-84-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NN=C(O2)SCC(=O)NC3=C(C=C(C=C3Cl)Cl)Cl |
Product Overview
CBKinase1_004309 (CAS 694472-84-9), with molecular formula C17H12Cl3N3O2S and molecular weight 426.97 g/mol. IUPAC: 2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2,4,6-trichlorophenyl)acetamide.
Chemical Property Profile of CBKinase1_004309
Property Insights of CBKinase1_004309
The XLogP value of 5.73602 indicates that CBKinase1_004309 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004309. Following Lipinski's Rule of Five, CBKinase1_004309 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_004309?
The CAS number of CBKinase1_004309 is 694472-84-9.
What is the molecular formula of CBKinase1_004309?
The molecular formula of CBKinase1_004309 is C17H12Cl3N3O2S.
What is the molecular weight of CBKinase1_004309?
The molecular weight of CBKinase1_004309 is 426.97 g/mol.
Where can I buy CBKinase1_004309?
You can request a quote for CBKinase1_004309 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004309?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004309 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.