CBKinase1_001876
TL;DR: CBKinase1_001876 (CAS 608121-58-0) is a chemical compound with molecular formula C23H19ClN2O3S2 and molecular weight 470.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[3-(furan-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-benzothiophene-2-carboxamide
Also Known As: CBKinase1_001876, CBKinase1_014276, AF-399/41702980, BRD-K51205530-001-01-5, 3-chloro-N-(3-{[(2-furylmethyl)amino]carbonyl}-4,5,6,7-tetrahydro-1-benzothien-2-yl)-1-benzothiophene-2-carboxamide
| Molecular Formula | C23H19ClN2O3S2 |
|---|---|
| Molecular Weight | 470.05 g/mol |
| LogP | 6.2703 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.05255 |
| Heavy Atoms | 31 |
| Complexity | 1273.7178 |
Chemical Identifiers
| CAS Number | 608121-58-0 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C(=O)NCC5=CC=CO5 |
Product Overview
CBKinase1_001876 (CAS 608121-58-0), with molecular formula C23H19ClN2O3S2 and molecular weight 470.05 g/mol. IUPAC: 3-chloro-N-[3-(furan-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of CBKinase1_001876
Property Insights of CBKinase1_001876
The XLogP value of 6.2703 indicates that CBKinase1_001876 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.34 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_001876. Following Lipinski's Rule of Five, CBKinase1_001876 has 2 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_001876?
The CAS number of CBKinase1_001876 is 608121-58-0.
What is the molecular formula of CBKinase1_001876?
The molecular formula of CBKinase1_001876 is C23H19ClN2O3S2.
What is the molecular weight of CBKinase1_001876?
The molecular weight of CBKinase1_001876 is 470.05 g/mol.
Where can I buy CBKinase1_001876?
You can request a quote for CBKinase1_001876 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_001876?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_001876 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.