TL;DR: 3-[(aminoiminomethyl)amino]-L-alanine monohydrochloride (CAS 1246276-62-9) is a chemical compound with molecular formula C4H11ClN4O2 and molecular weight 182.05705 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-amino-3-(diaminomethylideneamino)propanoic acid;hydrochloride
Also Known As: (S)-2-Amino-3-guanidinopropanoic acid hydrochloride, L-2-Amino-3-guanidinopropionic acid hydrochloride, EINECS 216-044-0, 3-Guanidino-L-alanine hydrochloride, l-a-amino-b-guanidinopropionic acid
| Molecular Formula | C4H11ClN4O2 |
| Molecular Weight | 182.05705 g/mol |
| XLogP | -1.9065 |
| Topological Polar Surface Area (TPSA) | 128.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.05705 Da |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
| SMILES | C([C@@H](C(=O)O)N)N=C(N)N.Cl |
| InChIKey | ZOXYHKHLLCDEAX-DKWTVANSSA-N |
The XLogP value of -1.9065 indicates that 3-[(aminoiminomethyl)amino]-L-alanine monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(aminoiminomethyl)amino]-L-alanine monohydrochloride. Following Lipinski's Rule of Five, 3-[(aminoiminomethyl)amino]-L-alanine monohydrochloride has 5 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 3-[(aminoiminomethyl)amino]-L-alanine monohydrochloride is 1246276-62-9.
The molecular formula of 3-[(aminoiminomethyl)amino]-L-alanine monohydrochloride is C4H11ClN4O2.
The molecular weight of 3-[(aminoiminomethyl)amino]-L-alanine monohydrochloride is 182.05705 g/mol.
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