CBKinase1_007688
TL;DR: CBKinase1_007688 (CAS 690646-74-3) is a chemical compound with molecular formula C12H9ClN6OS2 and molecular weight 352.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide
Also Known As: CBKinase1_007688, CBKinase1_020088, VU0618408-1, F3394-1174, AQ-750/42502640
| Molecular Formula | C12H9ClN6OS2 |
|---|---|
| Molecular Weight | 352.00 g/mol |
| LogP | 2.7074 |
| Topological Polar Surface Area | 96.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.99677 |
| Heavy Atoms | 22 |
| Complexity | 758.2867 |
Chemical Identifiers
| CAS Number | 690646-74-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC(=NS2)NC(=O)CSC3=NC=NN3)Cl |
Product Overview
CBKinase1_007688 (CAS 690646-74-3), with molecular formula C12H9ClN6OS2 and molecular weight 352.00 g/mol. IUPAC: N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide.
Chemical Property Profile of CBKinase1_007688
Property Insights of CBKinase1_007688
The XLogP value of 2.7074 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_007688. The TPSA of 96.45 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007688. Following Lipinski's Rule of Five, CBKinase1_007688 has 2 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_007688?
The CAS number of CBKinase1_007688 is 690646-74-3.
What is the molecular formula of CBKinase1_007688?
The molecular formula of CBKinase1_007688 is C12H9ClN6OS2.
What is the molecular weight of CBKinase1_007688?
The molecular weight of CBKinase1_007688 is 352.00 g/mol.
Where can I buy CBKinase1_007688?
You can request a quote for CBKinase1_007688 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007688?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007688 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.