TL;DR: Pivagabine (CAS 69542-93-4) is a chemical compound with molecular formula C9H17NO3 and molecular weight 187.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2,2-dimethylpropanoylamino)butanoic acid
Also Known As: Pivagabine, 4-Pivalamidobutanoic acid, pivagabin, Pivagabina, Tonerg
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H17NO3 |
| Molecular Weight | 187.12085 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 187.12085 Da |
| Heavy Atoms | 13 |
| Complexity | 194.0 |
| SMILES | CC(C)(C)C(=O)NCCCC(=O)O |
| InChIKey | SRPNQDXRVRCTNK-UHFFFAOYSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pivagabine. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Pivagabine. Following Lipinski's Rule of Five, Pivagabine has 2 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 Pivagabine is 69542-93-4.
The molecular formula of Pivagabine is C9H17NO3.
The molecular weight of Pivagabine is 187.12085 g/mol.
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