KN-62
TL;DR: KN-62 (CAS 127191-97-3) is a chemical compound with molecular formula C38H35N5O6S2 and molecular weight 721.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
KN-62
[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
| Molecular Formula | C38H35N5O6S2 |
|---|---|
| Molecular Weight | 721.20 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 721.2029 |
| Heavy Atoms | 51 |
| Complexity | 1370.0 |
Chemical Identifiers
| CAS Number | 127191-97-3 |
|---|---|
| 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 |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
KN-62 (CAS 127191-97-3), with molecular formula C38H35N5O6S2 and molecular weight 721.20 g/mol. IUPAC: [4-[2-[isoquinolin-5-ylsulfonyl(methyl)amino]-3-oxo-3-(4-phenylpiperazin-1-yl)propyl]phenyl] isoquinoline-5-sulfonate.
Chemical Property Profile of KN-62
Property Insights of KN-62
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 KN-62 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
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 721.20 g/mol.
Where can I buy BiomolKI2_000048?
You can request a quote for BiomolKI2_000048 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BiomolKI2_000048?
Yes, KEHONG BIO provides custom synthesis services for BiomolKI2_000048 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.