TL;DR: 1H-Indole, 5-(phenylmethoxy)-1-(4-pyridinylmethyl)- (CAS 141101-93-1) is a chemical compound with molecular formula C21H18N2O and molecular weight 314.1419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-phenylmethoxy-1-(pyridin-4-ylmethyl)indole
Also Known As: 1H-Indole, 5-(phenylmethoxy)-1-(4-pyridinylmethyl)-, 5-phenylmethoxy-1-(pyridin-4-ylmethyl)indole, 5-phenylmethoxy-1-(4-pyridinylmethyl)-1H-indole, 5-(Benzyloxy)-1-[(pyridin-4-yl)methyl]-1H-indole
| Molecular Formula | C21H18N2O |
| Molecular Weight | 314.1419 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 27.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.1419 Da |
| Heavy Atoms | 24 |
| Complexity | 376.0 |
| SMILES | C1=CC=C(C=C1)COC2=CC3=C(C=C2)N(C=C3)CC4=CC=NC=C4 |
| InChIKey | SMUOMHZNGDJUDJ-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 1H-Indole, 5-(phenylmethoxy)-1-(4-pyridinylmethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.1 Ų, 1H-Indole, 5-(phenylmethoxy)-1-(4-pyridinylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole, 5-(phenylmethoxy)-1-(4-pyridinylmethyl)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1H-Indole, 5-(phenylmethoxy)-1-(4-pyridinylmethyl)- is 141101-93-1.
The molecular formula of 1H-Indole, 5-(phenylmethoxy)-1-(4-pyridinylmethyl)- is C21H18N2O.
The molecular weight of 1H-Indole, 5-(phenylmethoxy)-1-(4-pyridinylmethyl)- is 314.1419 g/mol.
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