BiomolKI2_000048
TL;DR: BiomolKI2_000048 (CAS 127191-97-3) is a chemical compound with molecular formula C38H35N5O6S2 and molecular weight 721.2029 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[2-[isoquinolin-5-ylsulfonyl(methyl)amino]-3-oxo-3-(4-phenylpiperazin-1-yl)propyl]phenyl] isoquinoline-5-sulfonate
Also Known As: BiomolKI2_000048, KN62, KN 62, BMK1-E4, KBio2_000521
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C38H35N5O6S2 |
| Molecular Weight | 721.2029 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 147.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 721.2029 Da |
| Heavy Atoms | 51 |
| Complexity | 1370.0 |
| SMILES | CN(C(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2C=CN=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5)S(=O)(=O)C6=CC=CC7=C6C=CN=C7 |
| InChIKey | RJVLFQBBRSMWHX-UHFFFAOYSA-N |
Product Description
Applications: BiomolKI2_000048 is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies BiomolKI2_000048 (CAS 127191-97-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
BiomolKI2_000048 (CAS 127191-97-3) is a heterocyclic building block with the molecular formula C38H35N5O6S2 and a molecular weight of 721.2 g/mol. It is also known as KN-62 and BiomolKI_000040.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of BiomolKI2_000048
Property Insights of BiomolKI2_000048
The XLogP value of 5.6 indicates that BiomolKI2_000048 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 147.0 Ų indicates high polarity, suggesting BiomolKI2_000048 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BiomolKI2_000048 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of BiomolKI2_000048?
The CAS number of BiomolKI2_000048 is 127191-97-3.
What is the molecular formula of BiomolKI2_000048?
The molecular formula of BiomolKI2_000048 is C38H35N5O6S2.
What is the molecular weight of BiomolKI2_000048?
The molecular weight of BiomolKI2_000048 is 721.2029 g/mol.
What are the applications of BiomolKI2_000048?
BiomolKI2_000048 is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies BiomolKI2_000048 (CAS 127191-97-3)...
Where can I buy BiomolKI2_000048?
You can request a quote for BiomolKI2_000048 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BiomolKI2_000048?
Yes, CoreyChem provides custom synthesis services for BiomolKI2_000048 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.