TL;DR: (3R)-3-thiophen-2-yl-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid (CAS 115957-22-7) is a chemical compound with molecular formula C9H8F3NO3S and molecular weight 267.0177 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R)-3-thiophen-2-yl-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid
Also Known As: 3-(2-thienyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid, 3-thiophen-2-yl-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid, (3R)-3-thiophen-2-yl-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid
| Molecular Formula | C9H8F3NO3S |
| Molecular Weight | 267.0177 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 94.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 267.0177 Da |
| Heavy Atoms | 17 |
| Complexity | 308.0 |
| SMILES | C1=CSC(=C1)[C@@H](CC(=O)O)NC(=O)C(F)(F)F |
| InChIKey | LAPSEFLUNMVPQL-RXMQYKEDSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3R)-3-thiophen-2-yl-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid. The TPSA of 94.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R)-3-thiophen-2-yl-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid. Following Lipinski's Rule of Five, (3R)-3-thiophen-2-yl-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (3R)-3-thiophen-2-yl-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid is 115957-22-7.
The molecular formula of (3R)-3-thiophen-2-yl-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid is C9H8F3NO3S.
The molecular weight of (3R)-3-thiophen-2-yl-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid is 267.0177 g/mol.
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