CBKinase1_002852
TL;DR: CBKinase1_002852 (CAS 693238-09-4) is a chemical compound with molecular formula C21H18N4O2S3 and molecular weight 454.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1,2-dihydroacenaphthylen-1-yl]-4-methylbenzenesulfonamide
Also Known As: CBKinase1_002852, CBKinase1_015252, BRD-A93059062-001-01-4, N-(2-((5-amino-1,3,4-thiadiazol-2-yl)thio)-1,2-dihydroacenaphthylen-1-yl)-4-methylbenzenesulfonamide, N-[2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1,2-dihydroacenaphthylen-1-yl]-4-methylbenzenesulfonamide
| Molecular Formula | C21H18N4O2S3 |
|---|---|
| Molecular Weight | 454.06 g/mol |
| LogP | 4.44852 |
| Topological Polar Surface Area | 97.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 454.0592 |
| Heavy Atoms | 30 |
| Complexity | 1345.2015 |
Chemical Identifiers
| CAS Number | 693238-09-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2C(C3=CC=CC4=C3C2=CC=C4)SC5=NN=C(S5)N |
Product Overview
CBKinase1_002852 (CAS 693238-09-4), with molecular formula C21H18N4O2S3 and molecular weight 454.06 g/mol. IUPAC: N-[2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1,2-dihydroacenaphthylen-1-yl]-4-methylbenzenesulfonamide.
Chemical Property Profile of CBKinase1_002852
Property Insights of CBKinase1_002852
The XLogP value of 4.44852 indicates that CBKinase1_002852 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.97 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_002852. Following Lipinski's Rule of Five, CBKinase1_002852 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_002852?
The CAS number of CBKinase1_002852 is 693238-09-4.
What is the molecular formula of CBKinase1_002852?
The molecular formula of CBKinase1_002852 is C21H18N4O2S3.
What is the molecular weight of CBKinase1_002852?
The molecular weight of CBKinase1_002852 is 454.06 g/mol.
Where can I buy CBKinase1_002852?
You can request a quote for CBKinase1_002852 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002852?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002852 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.