TL;DR: L-Valine, N-(cyclohexylcarbonyl)- (CAS 118528-57-7) is a chemical compound with molecular formula C12H21NO3 and molecular weight 227.15215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(cyclohexanecarbonylamino)-3-methylbutanoic acid
Also Known As: L-Valine, N-(cyclohexylcarbonyl)-, (S)-2-(cyclohexanecarboxamido)-3-methylbutanoic acid, AB01316335-02, (2S)-2-(cyclohexylformamido)-3-methylbutanoic acid, 2-(cyclohexanecarbonylamino)-3-methyl-butanoic Acid
| Molecular Formula | C12H21NO3 |
| Molecular Weight | 227.15215 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 227.15215 Da |
| Heavy Atoms | 16 |
| Complexity | 257.0 |
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)C1CCCCC1 |
| InChIKey | XYLGNAIAXWHHNJ-JTQLQIEISA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L-Valine, N-(cyclohexylcarbonyl)-. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for L-Valine, N-(cyclohexylcarbonyl)-. Following Lipinski's Rule of Five, L-Valine, N-(cyclohexylcarbonyl)- 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 L-Valine, N-(cyclohexylcarbonyl)- is 118528-57-7.
The molecular formula of L-Valine, N-(cyclohexylcarbonyl)- is C12H21NO3.
The molecular weight of L-Valine, N-(cyclohexylcarbonyl)- is 227.15215 g/mol.
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