CBKinase1_002241
TL;DR: CBKinase1_002241 (CAS 693231-07-1) is a chemical compound with molecular formula C24H20FN3O4S2 and molecular weight 497.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-3,4-dimethoxybenzamide
Also Known As: CBKinase1_002241, CBKinase1_014641, BRD-K56819078-001-01-6, N-[2-({[(2-FLUOROPHENYL)CARBAMOYL]METHYL}SULFANYL)-1,3-BENZOTHIAZOL-6-YL]-3,4-DIMETHOXYBENZAMIDE, N-[2-[(2-fluorophenyl)carbamoylmethylsulfanyl]benzothiazol-6-yl]-3,4-dimethoxy-benzamide
| Molecular Formula | C24H20FN3O4S2 |
|---|---|
| Molecular Weight | 497.09 g/mol |
| LogP | 5.4357 |
| Topological Polar Surface Area | 89.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 497.08792 |
| Heavy Atoms | 34 |
| Complexity | 1359.3131 |
Chemical Identifiers
| CAS Number | 693231-07-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC=CC=C4F)OC |
Product Overview
CBKinase1_002241 (CAS 693231-07-1), with molecular formula C24H20FN3O4S2 and molecular weight 497.09 g/mol. IUPAC: N-[2-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-3,4-dimethoxybenzamide.
Chemical Property Profile of CBKinase1_002241
Property Insights of CBKinase1_002241
The XLogP value of 5.4357 indicates that CBKinase1_002241 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.55 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_002241. Following Lipinski's Rule of Five, CBKinase1_002241 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_002241?
The CAS number of CBKinase1_002241 is 693231-07-1.
What is the molecular formula of CBKinase1_002241?
The molecular formula of CBKinase1_002241 is C24H20FN3O4S2.
What is the molecular weight of CBKinase1_002241?
The molecular weight of CBKinase1_002241 is 497.09 g/mol.
Where can I buy CBKinase1_002241?
You can request a quote for CBKinase1_002241 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002241?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002241 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.