LY 203647
TL;DR: LY 203647 (CAS 122009-61-4) is a chemical compound with molecular formula C21H30N8O3 and molecular weight 442.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-hydroxy-3-propyl-4-[4-[2-[4-(2H-tetrazol-5-yl)butyl]tetrazol-5-yl]butoxy]phenyl]ethanone
Also Known As: Ethanone, 1-(2-hydroxy-3-propyl-4-(4-(2-(4-(1H-tetrazol-5-yl)butyl)-2H-tetrazol-5-yl)butoxy)phenyl)-, 1-(2-Hydroxy-3-propyl-4-(4-(2-(4-(1H-tetrazol-5-yl)butyl)2H-tetrazol-5-yl)butoxy)phenyl), 1-[2-hydroxy-3-propyl-4-[4-[2-[4-(2H-tetrazol-5-yl)butyl]tetrazol-5-yl]butoxy]phenyl]ethanone, 1-[2-hydroxy-3-propyl-4-(4-{2-[4-(1H-1,2,3,4-tetrazol-5-yl)butyl]-2H-1,2,3,4-tetrazol-5-yl}butoxy)phenyl]ethan-1-one, 1-[2-Hydroxy-3-propyl-4-(4-{2-[4-(2H-tetrazol-5-yl)butyl]-2H-tetrazol-5-yl}butoxy)phenyl]ethan-1-one
| Molecular Formula | C21H30N8O3 |
|---|---|
| Molecular Weight | 442.24 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 14 |
| Exact Mass | 442.24408 |
| Heavy Atoms | 32 |
| Complexity | 557.0 |
Chemical Identifiers
| CAS Number | 122009-61-4 |
|---|---|
| SMILES | CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCC2=NN(N=N2)CCCCC3=NNN=N3 |
| InChIKey | LTMJMFMIOHHHIQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
LY 203647 (CAS 122009-61-4), with molecular formula C21H30N8O3 and molecular weight 442.24 g/mol. IUPAC: 1-[2-hydroxy-3-propyl-4-[4-[2-[4-(2H-tetrazol-5-yl)butyl]tetrazol-5-yl]butoxy]phenyl]ethanone.
Chemical Property Profile of LY 203647
Property Insights of LY 203647
The XLogP value of 4.2 indicates that LY 203647 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.0 Ų indicates high polarity, suggesting LY 203647 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, LY 203647 has 2 hydrogen bond donor(s) and 9 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 LY 203647?
The CAS number of LY 203647 is 122009-61-4.
What is the molecular formula of LY 203647?
The molecular formula of LY 203647 is C21H30N8O3.
What is the molecular weight of LY 203647?
The molecular weight of LY 203647 is 442.24 g/mol.
Where can I buy LY 203647?
You can request a quote for LY 203647 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for LY 203647?
Yes, KEHONG BIO provides custom synthesis services for LY 203647 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.