TL;DR: Isopropyl 2-amino-4-phenylthiophene-3-carboxylate (CAS 351157-38-5) is a chemical compound with molecular formula C14H15NO2S and molecular weight 261.08234 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
propan-2-yl 2-amino-4-phenylthiophene-3-carboxylate
Also Known As: isopropyl 2-amino-4-phenylthiophene-3-carboxylate, propan-2-yl 2-amino-4-phenylthiophene-3-carboxylate, 2,3-Dichlor-3-phenyl-propionsaeure, BIM-0030692.P001, isopropyl2-amino-4-phenylthiophene-3-carboxylate
| Molecular Formula | C14H15NO2S |
| Molecular Weight | 261.08234 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 80.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.08234 Da |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
| SMILES | CC(C)OC(=O)C1=C(SC=C1C2=CC=CC=C2)N |
| InChIKey | UTTXADKTKIRQHK-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that Isopropyl 2-amino-4-phenylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Isopropyl 2-amino-4-phenylthiophene-3-carboxylate. Following Lipinski's Rule of Five, Isopropyl 2-amino-4-phenylthiophene-3-carboxylate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Isopropyl 2-amino-4-phenylthiophene-3-carboxylate is 351157-38-5.
The molecular formula of Isopropyl 2-amino-4-phenylthiophene-3-carboxylate is C14H15NO2S.
The molecular weight of Isopropyl 2-amino-4-phenylthiophene-3-carboxylate is 261.08234 g/mol.
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