MEK inhibitor I
TL;DR: MEK inhibitor I (CAS 297744-42-4) is a chemical compound with molecular formula C21H18N4OS and molecular weight 374.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-amino-3-(2-aminophenyl)sulfanyl-2-[3-[hydroxy(pyridin-4-yl)methyl]phenyl]prop-2-enenitrile
Also Known As: MEK Inhibitor I, MEK-IN-4, MEKi-1 compound, MEK-IN-I, EX-A11037
| Molecular Formula | C21H18N4OS |
|---|---|
| Molecular Weight | 374.12 g/mol |
| LogP | 3.68868 |
| Topological Polar Surface Area | 108.95 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.12012 |
| Heavy Atoms | 27 |
| Complexity | 1011.9451 |
Chemical Identifiers
| CAS Number | 297744-42-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N)S/C(=C(\C#N)/C2=CC=CC(=C2)C(C3=CC=NC=C3)O)/N |
Product Overview
MEK inhibitor I (CAS 297744-42-4), with molecular formula C21H18N4OS and molecular weight 374.12 g/mol. IUPAC: (Z)-3-amino-3-(2-aminophenyl)sulfanyl-2-[3-[hydroxy(pyridin-4-yl)methyl]phenyl]prop-2-enenitrile.
Chemical Property Profile of MEK inhibitor I
Property Insights of MEK inhibitor I
The XLogP value of 3.68868 indicates that MEK inhibitor I is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.95 Ų falls within the moderate polarity range, balancing permeability and solubility for MEK inhibitor I. Following Lipinski's Rule of Five, MEK inhibitor I has 3 hydrogen bond donor(s) and 6 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 MEK inhibitor I?
The CAS number of MEK inhibitor I is 297744-42-4.
What is the molecular formula of MEK inhibitor I?
The molecular formula of MEK inhibitor I is C21H18N4OS.
What is the molecular weight of MEK inhibitor I?
The molecular weight of MEK inhibitor I is 374.12 g/mol.
Where can I buy MEK inhibitor I?
You can request a quote for MEK inhibitor I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MEK inhibitor I?
Yes, KEHONG BIO provides custom synthesis services for MEK inhibitor I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.