TL;DR: (5S)-6-[6-[(3R)-3-hydroxyundeca-1,5-dienyl]-2-pyridinyl]hexane-1,5-diol (CAS 119477-85-9) is a chemical compound with molecular formula C22H35NO3 and molecular weight 361.2617 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5S)-6-[6-[(3R)-3-hydroxyundeca-1,5-dienyl]-2-pyridinyl]hexane-1,5-diol
Also Known As: (5S)-6-{6-[(1E,3R,5Z)-3-hydroxyundeca-1,5-dien-1-yl]pyridin-2-yl}hexane-1,5-diol
| Molecular Formula | C22H35NO3 |
| Molecular Weight | 361.2617 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 73.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 361.2617 Da |
| Heavy Atoms | 26 |
| Complexity | 384.0 |
| SMILES | CCCCCC=CC[C@H](C=CC1=CC=CC(=N1)C[C@H](CCCCO)O)O |
| InChIKey | JNBOAUIJLDEICX-YADHBBJMSA-N |
The XLogP value of 4.1 indicates that (5S)-6-[6-[(3R)-3-hydroxyundeca-1,5-dienyl]-2-pyridinyl]hexane-1,5-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (5S)-6-[6-[(3R)-3-hydroxyundeca-1,5-dienyl]-2-pyridinyl]hexane-1,5-diol. Following Lipinski's Rule of Five, (5S)-6-[6-[(3R)-3-hydroxyundeca-1,5-dienyl]-2-pyridinyl]hexane-1,5-diol has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (5S)-6-[6-[(3R)-3-hydroxyundeca-1,5-dienyl]-2-pyridinyl]hexane-1,5-diol is 119477-85-9.
The molecular formula of (5S)-6-[6-[(3R)-3-hydroxyundeca-1,5-dienyl]-2-pyridinyl]hexane-1,5-diol is C22H35NO3.
The molecular weight of (5S)-6-[6-[(3R)-3-hydroxyundeca-1,5-dienyl]-2-pyridinyl]hexane-1,5-diol is 361.2617 g/mol.
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