TL;DR: LY 203647 (CAS 122009-61-4) is a chemical compound with molecular formula C21H30N8O3 and molecular weight 442.24408 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-hydroxy-3-propyl-4-[4-[2-[4-(2H-tetrazol-5-yl)butyl]tetrazol-5-yl]butoxy]phenyl]ethanone
Also Known As: LY 203647, 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
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H30N8O3 |
| Molecular Weight | 442.24408 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 145.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 14 |
| Exact Mass | 442.24408 Da |
| Heavy Atoms | 32 |
| Complexity | 557.0 |
| SMILES | CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCC2=NN(N=N2)CCCCC3=NNN=N3 |
| InChIKey | LTMJMFMIOHHHIQ-UHFFFAOYSA-N |
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.
The CAS number of LY 203647 is 122009-61-4.
The molecular formula of LY 203647 is C21H30N8O3.
The molecular weight of LY 203647 is 442.24408 g/mol.
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