CBKinase1_003560
TL;DR: CBKinase1_003560 (CAS 662155-33-1) is a chemical compound with molecular formula C18H16N2O6S and molecular weight 388.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide
Also Known As: CBKinase1_003560, CBKinase1_015960, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)propanamide, VU0186705-5, AP-853/41872932
| Molecular Formula | C18H16N2O6S |
|---|---|
| Molecular Weight | 388.07 g/mol |
| LogP | 1.6311 |
| Topological Polar Surface Area | 102.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.0729 |
| Heavy Atoms | 27 |
| Complexity | 1033.8975 |
Chemical Identifiers
| CAS Number | 662155-33-1 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4S3(=O)=O |
Product Overview
CBKinase1_003560 (CAS 662155-33-1), with molecular formula C18H16N2O6S and molecular weight 388.07 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide.
Chemical Property Profile of CBKinase1_003560
Property Insights of CBKinase1_003560
The XLogP value of 1.6311 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_003560. The TPSA of 102.01 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003560. Following Lipinski's Rule of Five, CBKinase1_003560 has 1 hydrogen bond donor(s) and 6 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_003560?
The CAS number of CBKinase1_003560 is 662155-33-1.
What is the molecular formula of CBKinase1_003560?
The molecular formula of CBKinase1_003560 is C18H16N2O6S.
What is the molecular weight of CBKinase1_003560?
The molecular weight of CBKinase1_003560 is 388.07 g/mol.
Where can I buy CBKinase1_003560?
You can request a quote for CBKinase1_003560 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003560?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003560 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.