TL;DR: 2-(Phenylthio)thiophene (CAS 16718-12-0) is a chemical compound with molecular formula C10H8S2 and molecular weight 192.00674 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenylsulfanylthiophene
Also Known As: 2-(Phenylthio)thiophene, 2-phenylsulfanylthiophene, 2-(phenylsulfanyl)thiophene, Thiophene, 2-(phenylthio)-, 2-phenylthiothiophene
| Molecular Formula | C10H8S2 |
| Molecular Weight | 192.00674 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 53.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.00674 Da |
| Heavy Atoms | 12 |
| Complexity | 130.0 |
| SMILES | C1=CC=C(C=C1)SC2=CC=CS2 |
| InChIKey | JQTBWKNYWACCRU-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 2-(Phenylthio)thiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.5 Ų, 2-(Phenylthio)thiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Phenylthio)thiophene 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 2-(Phenylthio)thiophene is 16718-12-0.
The molecular formula of 2-(Phenylthio)thiophene is C10H8S2.
The molecular weight of 2-(Phenylthio)thiophene is 192.00674 g/mol.
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