CBKinase1_002858
TL;DR: CBKinase1_002858 (CAS 693239-88-2) is a chemical compound with molecular formula C17H13BrClN3O2S and molecular weight 436.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-chloro-4-methylphenyl)acetamide
Also Known As: CBKinase1_002858, CBKinase1_015258, BRD-K37867138-001-01-7, 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-chloro-4-methylphenyl)acetamide, 2-{[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(3-chloro-4-methylphenyl)acetamide
| Molecular Formula | C17H13BrClN3O2S |
|---|---|
| Molecular Weight | 436.96 g/mol |
| LogP | 5.19172 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 436.96005 |
| Heavy Atoms | 25 |
| Complexity | 899.1636 |
Chemical Identifiers
| CAS Number | 693239-88-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(O2)C3=CC=C(C=C3)Br)Cl |
Product Overview
CBKinase1_002858 (CAS 693239-88-2), with molecular formula C17H13BrClN3O2S and molecular weight 436.96 g/mol. IUPAC: 2-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-chloro-4-methylphenyl)acetamide.
Chemical Property Profile of CBKinase1_002858
Property Insights of CBKinase1_002858
The XLogP value of 5.19172 indicates that CBKinase1_002858 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_002858. Following Lipinski's Rule of Five, CBKinase1_002858 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_002858?
The CAS number of CBKinase1_002858 is 693239-88-2.
What is the molecular formula of CBKinase1_002858?
The molecular formula of CBKinase1_002858 is C17H13BrClN3O2S.
What is the molecular weight of CBKinase1_002858?
The molecular weight of CBKinase1_002858 is 436.96 g/mol.
Where can I buy CBKinase1_002858?
You can request a quote for CBKinase1_002858 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002858?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002858 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.