TL;DR: 2-(Furfurylthio)ethylamine (CAS 36415-21-1) is a chemical compound with molecular formula C7H11NOS and molecular weight 157.05614 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(furan-2-ylmethylsulfanyl)ethanamine
Also Known As: 2-(Furfurylthio)ethylamine, 2-((Furan-2-ylmethyl)thio)ethanamine, 2- ethylamine, 2-[(2-Aminoethylthio)methyl]furan, 2-(furan-2-ylmethylsulfanyl)ethanamine
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H11NOS |
| Molecular Weight | 157.05614 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 64.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 157.05614 Da |
| Heavy Atoms | 10 |
| Complexity | 89.0 |
| SMILES | C1=COC(=C1)CSCCN |
| InChIKey | VSPDYEHKAMKDNW-UHFFFAOYSA-N |
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Furfurylthio)ethylamine. The TPSA of 64.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Furfurylthio)ethylamine. Following Lipinski's Rule of Five, 2-(Furfurylthio)ethylamine 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 2-(Furfurylthio)ethylamine is 36415-21-1.
The molecular formula of 2-(Furfurylthio)ethylamine is C7H11NOS.
The molecular weight of 2-(Furfurylthio)ethylamine is 157.05614 g/mol.
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