9W-0884
TL;DR: 9W-0884 (CAS 866149-52-2) is a chemical compound with molecular formula C22H20N2O4 and molecular weight 376.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-oxoisoquinoline-4-carboxylate
Also Known As: 9W-0884, methyl 2-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxylate, methyl 2-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-oxo-1,2-dihydro-4-isoquinolinecarboxylate, methyl 2-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-oxoisoquinoline-4-carboxylate, Methyl 2-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-oxo-isoquinoline-4-carboxylate
| Molecular Formula | C22H20N2O4 |
|---|---|
| Molecular Weight | 376.14 g/mol |
| LogP | 3.5207 |
| Topological Polar Surface Area | 73.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.1423 |
| Heavy Atoms | 28 |
| Complexity | 1236.4817 |
Chemical Identifiers
| CAS Number | 866149-52-2 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)NC=C2CCN3C=C(C4=CC=CC=C4C3=O)C(=O)OC |
Product Overview
9W-0884 (CAS 866149-52-2), with molecular formula C22H20N2O4 and molecular weight 376.14 g/mol. IUPAC: methyl 2-[2-(5-methoxy-1H-indol-3-yl)ethyl]-1-oxoisoquinoline-4-carboxylate.
Chemical Property Profile of 9W-0884
Property Insights of 9W-0884
The XLogP value of 3.5207 indicates that 9W-0884 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 9W-0884. Following Lipinski's Rule of Five, 9W-0884 has 1 hydrogen bond donor(s) and 4 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 9W-0884?
The CAS number of 9W-0884 is 866149-52-2.
What is the molecular formula of 9W-0884?
The molecular formula of 9W-0884 is C22H20N2O4.
What is the molecular weight of 9W-0884?
The molecular weight of 9W-0884 is 376.14 g/mol.
Where can I buy 9W-0884?
You can request a quote for 9W-0884 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9W-0884?
Yes, KEHONG BIO provides custom synthesis services for 9W-0884 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.