TL;DR: 1-[(2R)-5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl]ethanone (CAS 62236-09-3) is a chemical compound with molecular formula C10H11N3OS and molecular weight 221.06229 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R)-5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl]ethanone
Also Known As: BAS 01968148, 1-(5-Amino-2-phenyl-[1,3,4]thiadiazol-3-yl)-ethanone, 1-[(2R)-5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl]ethanone
| Molecular Formula | C10H11N3OS |
| Molecular Weight | 221.06229 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 84.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.06229 Da |
| Heavy Atoms | 15 |
| Complexity | 286.0 |
| SMILES | CC(=O)N1[C@H](SC(=N1)N)C2=CC=CC=C2 |
| InChIKey | FSUOZVHASSEDMX-SECBINFHSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2R)-5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl]ethanone. The TPSA of 84.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2R)-5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl]ethanone. Following Lipinski's Rule of Five, 1-[(2R)-5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl]ethanone 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 1-[(2R)-5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl]ethanone is 62236-09-3.
The molecular formula of 1-[(2R)-5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl]ethanone is C10H11N3OS.
The molecular weight of 1-[(2R)-5-amino-2-phenyl-2H-1,3,4-thiadiazol-3-yl]ethanone is 221.06229 g/mol.
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