TL;DR: (4-Methoxyphenyl)(1-(phenylthio)cyclopropyl)methanol (CAS 144453-17-8) is a chemical compound with molecular formula C17H18O2S and molecular weight 286.10275 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methoxyphenyl)-(1-phenylsulfanylcyclopropyl)methanol
Also Known As: (4-METHOXYPHENYL)(1-(PHENYLTHIO)CYCLOPROPYL)METHANOL, (4-methoxyphenyl)-(1-phenylsulfanylcyclopropyl)methanol, (4-methoxyphenyl)[1-(phenylsulfanyl)cyclopropyl]methanol, 4-Methoxy-alpha-[1-(phenylthio)cyclopropyl]benzenemethanol
| Molecular Formula | C17H18O2S |
| Molecular Weight | 286.10275 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 54.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.10275 Da |
| Heavy Atoms | 20 |
| Complexity | 302.0 |
| SMILES | COC1=CC=C(C=C1)C(C2(CC2)SC3=CC=CC=C3)O |
| InChIKey | ZUCCPUNGCPZSBK-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that (4-Methoxyphenyl)(1-(phenylthio)cyclopropyl)methanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.8 Ų, (4-Methoxyphenyl)(1-(phenylthio)cyclopropyl)methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Methoxyphenyl)(1-(phenylthio)cyclopropyl)methanol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (4-Methoxyphenyl)(1-(phenylthio)cyclopropyl)methanol is 144453-17-8.
The molecular formula of (4-Methoxyphenyl)(1-(phenylthio)cyclopropyl)methanol is C17H18O2S.
The molecular weight of (4-Methoxyphenyl)(1-(phenylthio)cyclopropyl)methanol is 286.10275 g/mol.
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