TL;DR: (2S)-2-(4,5-dihydro-1H-imidazol-2-ylamino)propanoic acid (CAS 1396966-81-6) is a chemical compound with molecular formula C6H11N3O2 and molecular weight 157.08513 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(4,5-dihydro-1H-imidazol-2-ylamino)propanoic acid
Also Known As: n-(4,5-dihydro-1h-imidazol-2-yl)alanine, BAS 06502532, (2S)-2-(4,5-dihydro-1H-imidazol-2-ylamino)propanoic acid
| Molecular Formula | C6H11N3O2 |
| Molecular Weight | 157.08513 g/mol |
| XLogP | -1.0 |
| Topological Polar Surface Area (TPSA) | 73.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 157.08513 Da |
| Heavy Atoms | 11 |
| Complexity | 190.0 |
| SMILES | C[C@@H](C(=O)O)NC1=NCCN1 |
| InChIKey | AJSRGDZWHXLRQT-BYPYZUCNSA-N |
The XLogP value of -1.0 indicates that (2S)-2-(4,5-dihydro-1H-imidazol-2-ylamino)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-(4,5-dihydro-1H-imidazol-2-ylamino)propanoic acid. Following Lipinski's Rule of Five, (2S)-2-(4,5-dihydro-1H-imidazol-2-ylamino)propanoic acid has 3 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 (2S)-2-(4,5-dihydro-1H-imidazol-2-ylamino)propanoic acid is 1396966-81-6.
The molecular formula of (2S)-2-(4,5-dihydro-1H-imidazol-2-ylamino)propanoic acid is C6H11N3O2.
The molecular weight of (2S)-2-(4,5-dihydro-1H-imidazol-2-ylamino)propanoic acid is 157.08513 g/mol.
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