CBKinase1_003750
TL;DR: CBKinase1_003750 (CAS 354785-98-1) is a chemical compound with molecular formula C16H13ClN2O5S and molecular weight 380.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2-methoxyphenyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide
Also Known As: CBKinase1_003750, CBKinase1_016150, BAS 06497326, VU0495752-1, N-(5-chloro-2-methoxyphenyl)-2-(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)acetamide
| Molecular Formula | C16H13ClN2O5S |
|---|---|
| Molecular Weight | 380.02 g/mol |
| LogP | 2.1318 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.02338 |
| Heavy Atoms | 25 |
| Complexity | 974.2404 |
Chemical Identifiers
| CAS Number | 354785-98-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)NC(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O |
Product Overview
CBKinase1_003750 (CAS 354785-98-1), with molecular formula C16H13ClN2O5S and molecular weight 380.02 g/mol. IUPAC: N-(5-chloro-2-methoxyphenyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide.
Chemical Property Profile of CBKinase1_003750
Property Insights of CBKinase1_003750
The XLogP value of 2.1318 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_003750. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003750. Following Lipinski's Rule of Five, CBKinase1_003750 has 1 hydrogen bond donor(s) and 5 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_003750?
The CAS number of CBKinase1_003750 is 354785-98-1.
What is the molecular formula of CBKinase1_003750?
The molecular formula of CBKinase1_003750 is C16H13ClN2O5S.
What is the molecular weight of CBKinase1_003750?
The molecular weight of CBKinase1_003750 is 380.02 g/mol.
Where can I buy CBKinase1_003750?
You can request a quote for CBKinase1_003750 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003750?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003750 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.